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Benzenoids

Organic compounds that are derived from or have a benzene group in their molecular structure. Benzene is an aromatic organic molecule composed of 6 carbon atoms and 6 hydrogen atoms that form a ring. Includes derivatives and substituted molecules.
Benzene and substituted derivatives (129,841)
Phenols (24,878)
Naphthalenes (6,294)
Phenol esters (4,685)
Unsubstituted Phenols (1,453)
Fluorenes (1,297)
Thiophenols (748)
Anthracenes (509)
Indanes (489)
Phenanthrenes and derivatives (364)
Tetralins (340)
Pyrenes (281)
Triphenyl compounds (280)
Dibenzocycloheptenes (60)
Naphthacenes (35)
Ellagic acids and derivatives (33)
Pentacenes (20)
Acenaphthylenes (17)
Pentacenequinones (16)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (5)

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1,321 – 1,335 of 158,365 results
1,321
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2-Methylbenzotrifluoride, 97%

CAS: 13630-19-8 Molecular Formula: C8H7F3 Molecular Weight (g/mol): 160.14 MDL Number: MFCD00153204 InChI Key: DVFVNJHIVAPTMS-UHFFFAOYSA-N Synonym: 2-methylbenzotrifluoride,1-methyl-2-trifluoromethyl benzene,2-trifluoromethyl toluene,1-methyl-2-trifluoromethyl-benzene,alpha,alpha,alpha-trifluoro-o-xylene,benzene, methyl trifluoromethyl,benzene, 1-methyl-2-trifluoromethyl,2-methyl-1-trifluoromethyl benzene,trifluoromethyltoluene,pubchem1657 PubChem CID: 2775324 IUPAC Name: 1-methyl-2-(trifluoromethyl)benzene SMILES: CC1=CC=CC=C1C(F)(F)F

PubChem CID 2775324
CAS 13630-19-8
Molecular Weight (g/mol) 160.14
MDL Number MFCD00153204
SMILES CC1=CC=CC=C1C(F)(F)F
Synonym 2-methylbenzotrifluoride,1-methyl-2-trifluoromethyl benzene,2-trifluoromethyl toluene,1-methyl-2-trifluoromethyl-benzene,alpha,alpha,alpha-trifluoro-o-xylene,benzene, methyl trifluoromethyl,benzene, 1-methyl-2-trifluoromethyl,2-methyl-1-trifluoromethyl benzene,trifluoromethyltoluene,pubchem1657
IUPAC Name 1-methyl-2-(trifluoromethyl)benzene
InChI Key DVFVNJHIVAPTMS-UHFFFAOYSA-N
Molecular Formula C8H7F3
1,322
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3-(Trifluoromethylthio)aniline, 96%

CAS: 369-68-6 Molecular Formula: C7H6F3NS Molecular Weight (g/mol): 193.19 MDL Number: MFCD00190130 InChI Key: DENPAKQJZNDKEL-UHFFFAOYSA-N Synonym: 3-trifluoromethylthio aniline,3-trifluoromethyl sulfanyl aniline,3-aminophenyl trifluoromethyl sulphide,3-aminophenyl trifluoromethyl sulfide,3-trifluoromethyl thio aniline,3-trifluoromethylsulfanyl aniline,benzenamine, 3-trifluoromethyl thio,benzeneamine, 3-trifluoromethyl thio,3-trifluoromethylthio phenylamine PubChem CID: 2735939 IUPAC Name: 3-(trifluoromethylsulfanyl)aniline SMILES: NC1=CC=CC(SC(F)(F)F)=C1

PubChem CID 2735939
CAS 369-68-6
Molecular Weight (g/mol) 193.19
MDL Number MFCD00190130
SMILES NC1=CC=CC(SC(F)(F)F)=C1
Synonym 3-trifluoromethylthio aniline,3-trifluoromethyl sulfanyl aniline,3-aminophenyl trifluoromethyl sulphide,3-aminophenyl trifluoromethyl sulfide,3-trifluoromethyl thio aniline,3-trifluoromethylsulfanyl aniline,benzenamine, 3-trifluoromethyl thio,benzeneamine, 3-trifluoromethyl thio,3-trifluoromethylthio phenylamine
IUPAC Name 3-(trifluoromethylsulfanyl)aniline
InChI Key DENPAKQJZNDKEL-UHFFFAOYSA-N
Molecular Formula C7H6F3NS
1,323
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3-Fluoro-4-nitrophenol, 99%

CAS: 394-41-2 Molecular Formula: C6H4FNO3 Molecular Weight (g/mol): 157.1 MDL Number: MFCD00041251 InChI Key: CSSGKHVRDGATJL-UHFFFAOYSA-N Synonym: phenol, 3-fluoro-4-nitro,3-fluoro-4-nitro-phenol,2-fluoro-4-hydroxynitrobenzene,pubchem2101,3-fluoro4-nitrophenol,4-nitro-3-fluorophenol,5-fluoro-4-nitrophenol,acmc-1afpw,3-fluoro-4-nitro phenol,ksc490k8p PubChem CID: 520948 IUPAC Name: 3-fluoro-4-nitrophenol SMILES: C1=CC(=C(C=C1O)F)[N+](=O)[O-]

PubChem CID 520948
CAS 394-41-2
Molecular Weight (g/mol) 157.1
MDL Number MFCD00041251
SMILES C1=CC(=C(C=C1O)F)[N+](=O)[O-]
Synonym phenol, 3-fluoro-4-nitro,3-fluoro-4-nitro-phenol,2-fluoro-4-hydroxynitrobenzene,pubchem2101,3-fluoro4-nitrophenol,4-nitro-3-fluorophenol,5-fluoro-4-nitrophenol,acmc-1afpw,3-fluoro-4-nitro phenol,ksc490k8p
IUPAC Name 3-fluoro-4-nitrophenol
InChI Key CSSGKHVRDGATJL-UHFFFAOYSA-N
Molecular Formula C6H4FNO3
1,324
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2-chloro-4-hydroxybenzoic acid hydrate, 98%

CAS: 56363-84-9 Molecular Formula: C7H5ClO3 Molecular Weight (g/mol): 172.56 MDL Number: MFCD00798116 InChI Key: WIPYZRZPNMUSER-UHFFFAOYSA-N Synonym: benzoic acid, 2-chloro-4-hydroxy,2-chloro-4-hydroxy-benzoic acid,2-chloro-4-hyroxybenzoic acid,pubchem4561,acmc-1b14n,ksc497o6l,4-hydroxy-2-chlorobenzoic acid,wipyzrzpnmuser-uhfffaoysa PubChem CID: 91821 IUPAC Name: 2-chloro-4-hydroxybenzoic acid SMILES: OC(=O)C1=CC=C(O)C=C1Cl

PubChem CID 91821
CAS 56363-84-9
Molecular Weight (g/mol) 172.56
MDL Number MFCD00798116
SMILES OC(=O)C1=CC=C(O)C=C1Cl
Synonym benzoic acid, 2-chloro-4-hydroxy,2-chloro-4-hydroxy-benzoic acid,2-chloro-4-hyroxybenzoic acid,pubchem4561,acmc-1b14n,ksc497o6l,4-hydroxy-2-chlorobenzoic acid,wipyzrzpnmuser-uhfffaoysa
IUPAC Name 2-chloro-4-hydroxybenzoic acid
InChI Key WIPYZRZPNMUSER-UHFFFAOYSA-N
Molecular Formula C7H5ClO3
1,325
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4-(chloromethyl)benzoyl chloride, 97%

CAS: 876-08-4 Molecular Formula: C8H6Cl2O Molecular Weight (g/mol): 189.04 MDL Number: MFCD00053224 InChI Key: RCOVTJVRTZGSBP-UHFFFAOYSA-N Synonym: 4-chloromethyl benzoyl chloride,benzoyl chloride, 4-chloromethyl,4-chloromethyl benzoylchloride,4-chloromethyl-benzoyl chloride,acmc-209qop,4-chlormethylbenzoylchloride,4-chloromethylbenzoylchloride,4-chlormethyl benzoylchlorid,p-chloromethylbenzoyl chloride PubChem CID: 70136 IUPAC Name: 4-(chloromethyl)benzoyl chloride SMILES: C1=CC(=CC=C1CCl)C(=O)Cl

PubChem CID 70136
CAS 876-08-4
Molecular Weight (g/mol) 189.04
MDL Number MFCD00053224
SMILES C1=CC(=CC=C1CCl)C(=O)Cl
Synonym 4-chloromethyl benzoyl chloride,benzoyl chloride, 4-chloromethyl,4-chloromethyl benzoylchloride,4-chloromethyl-benzoyl chloride,acmc-209qop,4-chlormethylbenzoylchloride,4-chloromethylbenzoylchloride,4-chlormethyl benzoylchlorid,p-chloromethylbenzoyl chloride
IUPAC Name 4-(chloromethyl)benzoyl chloride
InChI Key RCOVTJVRTZGSBP-UHFFFAOYSA-N
Molecular Formula C8H6Cl2O
1,326
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3-(chloromethyl)benzoyl chloride, 98%

CAS: 63024-77-1 Molecular Formula: C8H6Cl2O Molecular Weight (g/mol): 189.04 MDL Number: MFCD00000682 InChI Key: YCAIYRWHKSJKEB-UHFFFAOYSA-N Synonym: 3-chloromethyl benzoyl chloride,3-chloromethyl benzoylchloride,3-chloromethyl-benzoyl chloride,benzoyl chloride, 3-chloromethyl,pubchem16448,3-chlormethylbenzoylchloride,3-chloromethylbenzoylchloride,acmc-1b65n PubChem CID: 2733324 IUPAC Name: 3-(chloromethyl)benzoyl chloride SMILES: C1=CC(=CC(=C1)CCl)C(=O)Cl

PubChem CID 2733324
CAS 63024-77-1
Molecular Weight (g/mol) 189.04
MDL Number MFCD00000682
SMILES C1=CC(=CC(=C1)CCl)C(=O)Cl
Synonym 3-chloromethyl benzoyl chloride,3-chloromethyl benzoylchloride,3-chloromethyl-benzoyl chloride,benzoyl chloride, 3-chloromethyl,pubchem16448,3-chlormethylbenzoylchloride,3-chloromethylbenzoylchloride,acmc-1b65n
IUPAC Name 3-(chloromethyl)benzoyl chloride
InChI Key YCAIYRWHKSJKEB-UHFFFAOYSA-N
Molecular Formula C8H6Cl2O
1,327
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Chlorthalidone, 98%

CAS: 77-36-1 Molecular Formula: C14H11ClN2O4S Molecular Weight (g/mol): 338.77 InChI Key: JIVPVXMEBJLZRO-UHFFFAOYSA-N Synonym: chlorthalidone,chlortalidone,phthalamudine,chlorphthalidolone,hygroton,chlorthalidon,phthalamodine,chlorothalidone,chlorphthalidone,natriuran PubChem CID: 2732 ChEBI: CHEBI:3654 IUPAC Name: 2-chloro-5-(1-hydroxy-3-oxo-2H-isoindol-1-yl)benzenesulfonamide SMILES: C1=CC=C2C(=C1)C(=O)NC2(C3=CC(=C(C=C3)Cl)S(=O)(=O)N)O

PubChem CID 2732
CAS 77-36-1
Molecular Weight (g/mol) 338.77
ChEBI CHEBI:3654
SMILES C1=CC=C2C(=C1)C(=O)NC2(C3=CC(=C(C=C3)Cl)S(=O)(=O)N)O
Synonym chlorthalidone,chlortalidone,phthalamudine,chlorphthalidolone,hygroton,chlorthalidon,phthalamodine,chlorothalidone,chlorphthalidone,natriuran
IUPAC Name 2-chloro-5-(1-hydroxy-3-oxo-2H-isoindol-1-yl)benzenesulfonamide
InChI Key JIVPVXMEBJLZRO-UHFFFAOYSA-N
Molecular Formula C14H11ClN2O4S
1,328
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2-Chloroethyl phenyl sulfide, 98%

CAS: 5535-49-9 Molecular Formula: C8H9ClS Molecular Weight (g/mol): 172.67 MDL Number: MFCD00013691 InChI Key: QDXIHHOPZFCEAP-UHFFFAOYSA-N Synonym: 2-chloroethyl phenyl sulfide,2-chloroethyl phenyl sulfane,2-chloroethyl sulfanyl benzene,2-chloroethyl thio benzene,2-chloroethylphenylsulfide,benzene, 2-chloroethyl thio,2-phenylthio ethyl chloride,2-phenylthioethylchloride,acmc-1axe6 PubChem CID: 21702 IUPAC Name: 2-chloroethylsulfanylbenzene SMILES: ClCCSC1=CC=CC=C1

PubChem CID 21702
CAS 5535-49-9
Molecular Weight (g/mol) 172.67
MDL Number MFCD00013691
SMILES ClCCSC1=CC=CC=C1
Synonym 2-chloroethyl phenyl sulfide,2-chloroethyl phenyl sulfane,2-chloroethyl sulfanyl benzene,2-chloroethyl thio benzene,2-chloroethylphenylsulfide,benzene, 2-chloroethyl thio,2-phenylthio ethyl chloride,2-phenylthioethylchloride,acmc-1axe6
IUPAC Name 2-chloroethylsulfanylbenzene
InChI Key QDXIHHOPZFCEAP-UHFFFAOYSA-N
Molecular Formula C8H9ClS
1,329
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1,3-Benzenedimethanol, 98%

CAS: 626-18-6 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.166 MDL Number: MFCD00004649 InChI Key: YWMLORGQOFONNT-UHFFFAOYSA-N Synonym: 1,3-benzenedimethanol,3-hydroxymethyl phenyl methanol,1,3-phenylenedimethanol,1,3-dihydroxymethylbenzene,m-xylene-alpha,alpha'-diol,m-xylene glycol,m-xylylene glycol,3-hydroxymethyl phenyl methan-1-ol,m-xylylenalkohol,m-benzenedimethanol PubChem CID: 69374 IUPAC Name: [3-(hydroxymethyl)phenyl]methanol SMILES: C1=CC(=CC(=C1)CO)CO

PubChem CID 69374
CAS 626-18-6
Molecular Weight (g/mol) 138.166
MDL Number MFCD00004649
SMILES C1=CC(=CC(=C1)CO)CO
Synonym 1,3-benzenedimethanol,3-hydroxymethyl phenyl methanol,1,3-phenylenedimethanol,1,3-dihydroxymethylbenzene,m-xylene-alpha,alpha'-diol,m-xylene glycol,m-xylylene glycol,3-hydroxymethyl phenyl methan-1-ol,m-xylylenalkohol,m-benzenedimethanol
IUPAC Name [3-(hydroxymethyl)phenyl]methanol
InChI Key YWMLORGQOFONNT-UHFFFAOYSA-N
Molecular Formula C8H10O2
1,330
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2,4,6-Trimethoxybenzonitrile, 98%

CAS: 2571-54-2 Molecular Formula: C10H11NO3 Molecular Weight (g/mol): 193.202 MDL Number: MFCD00001787 InChI Key: GBRHJUMDNWLSCT-UHFFFAOYSA-N PubChem CID: 75731 IUPAC Name: 2,4,6-trimethoxybenzonitrile SMILES: COC1=CC(=C(C(=C1)OC)C#N)OC

PubChem CID 75731
CAS 2571-54-2
Molecular Weight (g/mol) 193.202
MDL Number MFCD00001787
SMILES COC1=CC(=C(C(=C1)OC)C#N)OC
IUPAC Name 2,4,6-trimethoxybenzonitrile
InChI Key GBRHJUMDNWLSCT-UHFFFAOYSA-N
Molecular Formula C10H11NO3
1,331
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m-Thiocresol, 97%

CAS: 108-40-7 Molecular Formula: C7H8S Molecular Weight (g/mol): 124.20 MDL Number: MFCD00004843 InChI Key: WRXOZRLZDJAYDR-UHFFFAOYSA-N Synonym: m-thiocresol,m-toluenethiol,3-methylthiophenol,3-thiocresol,benzenethiol, 3-methyl,m-methylbenzenethiol,m-methylthiophenol,3-mercaptotoluene,m-tolylmercaptan,m-mercaptotoluene PubChem CID: 7930 IUPAC Name: 3-methylbenzenethiol SMILES: CC1=CC=CC(S)=C1

PubChem CID 7930
CAS 108-40-7
Molecular Weight (g/mol) 124.20
MDL Number MFCD00004843
SMILES CC1=CC=CC(S)=C1
Synonym m-thiocresol,m-toluenethiol,3-methylthiophenol,3-thiocresol,benzenethiol, 3-methyl,m-methylbenzenethiol,m-methylthiophenol,3-mercaptotoluene,m-tolylmercaptan,m-mercaptotoluene
IUPAC Name 3-methylbenzenethiol
InChI Key WRXOZRLZDJAYDR-UHFFFAOYSA-N
Molecular Formula C7H8S
1,332
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2-Hydroxy-1-naphthaldehyde, 98%

CAS: 708-06-5 Molecular Formula: C11H8O2 Molecular Weight (g/mol): 172.183 MDL Number: MFCD00004005 InChI Key: NTCCNERMXRIPTR-UHFFFAOYSA-N Synonym: 2-hydroxy-1-naphthaldehyde,1-formyl-2-naphthol,2-hydroxy-1-naphthylaldehyde,2-hydroxy-1-napthaldehyde,2-hydroxynaphthaldehyde,2-naphthol 1-carboxaldehyde,2-hydroxy-1-naphthalaldehyde,1-naphthalenecarboxaldehyde, 2-hydroxy,2-hydroxy-1-naphthalenecarboxaldehyde,1-hydroxy-2-naphthalenecarboxaldehyde PubChem CID: 12819 IUPAC Name: 2-hydroxynaphthalene-1-carbaldehyde SMILES: C1=CC=C2C(=C1)C=CC(=C2C=O)O

PubChem CID 12819
CAS 708-06-5
Molecular Weight (g/mol) 172.183
MDL Number MFCD00004005
SMILES C1=CC=C2C(=C1)C=CC(=C2C=O)O
Synonym 2-hydroxy-1-naphthaldehyde,1-formyl-2-naphthol,2-hydroxy-1-naphthylaldehyde,2-hydroxy-1-napthaldehyde,2-hydroxynaphthaldehyde,2-naphthol 1-carboxaldehyde,2-hydroxy-1-naphthalaldehyde,1-naphthalenecarboxaldehyde, 2-hydroxy,2-hydroxy-1-naphthalenecarboxaldehyde,1-hydroxy-2-naphthalenecarboxaldehyde
IUPAC Name 2-hydroxynaphthalene-1-carbaldehyde
InChI Key NTCCNERMXRIPTR-UHFFFAOYSA-N
Molecular Formula C11H8O2
1,333
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Benzenesulfonyl hydrazide, 98%

CAS: 80-17-1 Molecular Formula: C6H8N2O2S Molecular Weight (g/mol): 172.20 MDL Number: MFCD00007583,MFCD08064450 InChI Key: VJRITMATACIYAF-UHFFFAOYSA-N Synonym: benzenesulfonyl hydrazide,porofor,benzenesulfonic acid, hydrazide,porofor bsh,benzenesulfohydrazide,phenylsulfonylhydrazine,genitron bsh,celogen bsh,benzenesulfonylhydrazine,phenylsulfohydrazide PubChem CID: 65723 IUPAC Name: benzenesulfonohydrazide SMILES: NNS(=O)(=O)C1=CC=CC=C1

PubChem CID 65723
CAS 80-17-1
Molecular Weight (g/mol) 172.20
MDL Number MFCD00007583,MFCD08064450
SMILES NNS(=O)(=O)C1=CC=CC=C1
Synonym benzenesulfonyl hydrazide,porofor,benzenesulfonic acid, hydrazide,porofor bsh,benzenesulfohydrazide,phenylsulfonylhydrazine,genitron bsh,celogen bsh,benzenesulfonylhydrazine,phenylsulfohydrazide
IUPAC Name benzenesulfonohydrazide
InChI Key VJRITMATACIYAF-UHFFFAOYSA-N
Molecular Formula C6H8N2O2S
1,334
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(2-[2-(Fmoc-amino)ethoxy]ethoxy)acetic acid, 95%

CAS: 166108-71-0 Molecular Formula: C21H23NO6 Molecular Weight (g/mol): 385.416 MDL Number: MFCD01321015 InChI Key: XQPYRJIMPDBGRW-UHFFFAOYSA-N Synonym: 2-2-fmoc-amino ethoxy ethoxy acetic acid,fmoc-nh-peg2-ch2cooh,fmoc-aeea,1-9h-fluoren-9-yl-3-oxo-2,7,10-trioxa-4-azadodecan-12-oic acid,8-fmoc-amino-3,6-dioxaoctanoic acid,fmoc-adoa,fmoc-aeeac-oh,fmoc-amino-3,6 dioxaoctanoic acid,8-fmoc-amino-3,6-dioxa-n-octanoic acid PubChem CID: 2756092 IUPAC Name: 2-[2-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethoxy]ethoxy]acetic acid SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NCCOCCOCC(=O)O

PubChem CID 2756092
CAS 166108-71-0
Molecular Weight (g/mol) 385.416
MDL Number MFCD01321015
SMILES C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NCCOCCOCC(=O)O
Synonym 2-2-fmoc-amino ethoxy ethoxy acetic acid,fmoc-nh-peg2-ch2cooh,fmoc-aeea,1-9h-fluoren-9-yl-3-oxo-2,7,10-trioxa-4-azadodecan-12-oic acid,8-fmoc-amino-3,6-dioxaoctanoic acid,fmoc-adoa,fmoc-aeeac-oh,fmoc-amino-3,6 dioxaoctanoic acid,8-fmoc-amino-3,6-dioxa-n-octanoic acid
IUPAC Name 2-[2-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethoxy]ethoxy]acetic acid
InChI Key XQPYRJIMPDBGRW-UHFFFAOYSA-N
Molecular Formula C21H23NO6
1,335

N-Fmoc-L-beta-homovaline, 95%

CAS: 172695-33-9 Molecular Formula: C21H23NO4 Molecular Weight (g/mol): 353.42 MDL Number: MFCD01862853 InChI Key: KFDMTAMWOIQTOB-LJQANCHMSA-N Synonym: fmoc-l-beta-homovaline,r-3-9h-fluoren-9-yl methoxy carbonyl amino-4-methylpentanoic acid,fmoc-beta-hoval-oh,r-n-fmoc-3-amino-4-methylpentanoic acid,r-3-fmoc-amino-4-methylpentanoic acid,3r-3-9h-fluoren-9-ylmethoxy carbonyl amino-4-methylpentanoic acid,fmoc-beta-leu-oh,fmoc-l-,a-leucine,fmoc-l-beta-leucine,fmoc-,a-hoval-oh PubChem CID: 2761560 IUPAC Name: (3R)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoic acid SMILES: CC(C)[C@@H](CC(O)=O)NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12

PubChem CID 2761560
CAS 172695-33-9
Molecular Weight (g/mol) 353.42
MDL Number MFCD01862853
SMILES CC(C)[C@@H](CC(O)=O)NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12
Synonym fmoc-l-beta-homovaline,r-3-9h-fluoren-9-yl methoxy carbonyl amino-4-methylpentanoic acid,fmoc-beta-hoval-oh,r-n-fmoc-3-amino-4-methylpentanoic acid,r-3-fmoc-amino-4-methylpentanoic acid,3r-3-9h-fluoren-9-ylmethoxy carbonyl amino-4-methylpentanoic acid,fmoc-beta-leu-oh,fmoc-l-,a-leucine,fmoc-l-beta-leucine,fmoc-,a-hoval-oh
IUPAC Name (3R)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoic acid
InChI Key KFDMTAMWOIQTOB-LJQANCHMSA-N
Molecular Formula C21H23NO4