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.

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10,351 – 10,365 of 78,439 results

10,351

4-Guanidinobenzoic Acid Hydrochloride 97.0+%, TCI America™

CAS: 42823-46-1 Molecular Formula: C8H10ClN3O2 Molecular Weight (g/mol): 215.637 MDL Number: MFCD00040587 InChI Key: YETFLAUJROGBMC-UHFFFAOYSA-N Synonym: 4-guanidinobenzoic acid hydrochloride,n-4-carboxyphenyl guanidine hydrochloride,4-guanidinobenzoic acid hcl,4-guanidino benzoic acid hydrochloride,4-amidinoamino benzoic acid, chloride,pubchem14981,pubchem14993,acmc-1an3m,ksc494a0j,4-guanidino-benzoic acid-hcl salt PubChem CID: 3084875 IUPAC Name: 4-(diaminomethylideneamino)benzoic acid;hydrochloride SMILES: C1=CC(=CC=C1C(=O)O)N=C(N)N.Cl

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Specifications

PubChem CID	3084875
CAS	42823-46-1
Molecular Weight (g/mol)	215.637
MDL Number	MFCD00040587
SMILES	C1=CC(=CC=C1C(=O)O)N=C(N)N.Cl
Synonym	4-guanidinobenzoic acid hydrochloride,n-4-carboxyphenyl guanidine hydrochloride,4-guanidinobenzoic acid hcl,4-guanidino benzoic acid hydrochloride,4-amidinoamino benzoic acid, chloride,pubchem14981,pubchem14993,acmc-1an3m,ksc494a0j,4-guanidino-benzoic acid-hcl salt
IUPAC Name	4-(diaminomethylideneamino)benzoic acid;hydrochloride
InChI Key	YETFLAUJROGBMC-UHFFFAOYSA-N
Molecular Formula	C8H10ClN3O2

10,352

N-(3-Chlorophenyl)anthranilic Acid 98.0+%, TCI America™

CAS: 13278-36-9 Molecular Formula: C13H10ClNO2 Molecular Weight (g/mol): 247.68 MDL Number: MFCD01928172 InChI Key: OVMWPVYEBVFZHM-UHFFFAOYSA-N Synonym: 2-[(3-Chlorophenyl)amino]benzoic Acid, 2-(3-Chloroanilino)benzoic Acid PubChem CID: 83293 IUPAC Name: 2-[(3-chlorophenyl)amino]benzoic acid SMILES: OC(=O)C1=CC=CC=C1NC1=CC=CC(Cl)=C1

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Specifications

PubChem CID	83293
CAS	13278-36-9
Molecular Weight (g/mol)	247.68
MDL Number	MFCD01928172
SMILES	OC(=O)C1=CC=CC=C1NC1=CC=CC(Cl)=C1
Synonym	2-[(3-Chlorophenyl)amino]benzoic Acid, 2-(3-Chloroanilino)benzoic Acid
IUPAC Name	2-[(3-chlorophenyl)amino]benzoic acid
InChI Key	OVMWPVYEBVFZHM-UHFFFAOYSA-N
Molecular Formula	C13H10ClNO2

10,353

5-Aminosalicylic Acid 98.0+%, TCI America™

CAS: 89-57-6 Molecular Formula: C7H7NO3 Molecular Weight (g/mol): 153.137 MDL Number: MFCD00007877 InChI Key: KBOPZPXVLCULAV-UHFFFAOYSA-N Synonym: 5-aminosalicylic acid,mesalazine,mesalamine,pentasa,claversal,asacol,canasa,salofalk,rowasa,5-asa PubChem CID: 4075 ChEBI: CHEBI:6775 IUPAC Name: 5-amino-2-hydroxybenzoic acid SMILES: C1=CC(=C(C=C1N)C(=O)O)O

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Specifications

PubChem CID	4075
CAS	89-57-6
Molecular Weight (g/mol)	153.137
ChEBI	CHEBI:6775
MDL Number	MFCD00007877
SMILES	C1=CC(=C(C=C1N)C(=O)O)O
Synonym	5-aminosalicylic acid,mesalazine,mesalamine,pentasa,claversal,asacol,canasa,salofalk,rowasa,5-asa
IUPAC Name	5-amino-2-hydroxybenzoic acid
InChI Key	KBOPZPXVLCULAV-UHFFFAOYSA-N
Molecular Formula	C7H7NO3

10,354

4-Amino-2-fluorobenzoic Acid 98.0+%, TCI America™

CAS: 446-31-1 Molecular Formula: C7H6FNO2 Molecular Weight (g/mol): 155.128 MDL Number: MFCD01569397 InChI Key: QHERSCUZBKDVOC-UHFFFAOYSA-N Synonym: 2-fluoro-4-aminobenzoic acid,4-amino-2-fluorobenzoicacid,4-amino-2-fluorobenzenecarboxylic acid,4-amino-2-fluoro-benzoic acid,4-carboxy-3-fluoroaniline,benzoic acid, 4-amino-2-fluoro,pubchem4693,acmc-209jz6,ksc237k0f,4-amino-2-fluoro benzoic acid PubChem CID: 302680 IUPAC Name: 4-amino-2-fluorobenzoic acid SMILES: C1=CC(=C(C=C1N)F)C(=O)O

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Specifications

PubChem CID	302680
CAS	446-31-1
Molecular Weight (g/mol)	155.128
MDL Number	MFCD01569397
SMILES	C1=CC(=C(C=C1N)F)C(=O)O
Synonym	2-fluoro-4-aminobenzoic acid,4-amino-2-fluorobenzoicacid,4-amino-2-fluorobenzenecarboxylic acid,4-amino-2-fluoro-benzoic acid,4-carboxy-3-fluoroaniline,benzoic acid, 4-amino-2-fluoro,pubchem4693,acmc-209jz6,ksc237k0f,4-amino-2-fluoro benzoic acid
IUPAC Name	4-amino-2-fluorobenzoic acid
InChI Key	QHERSCUZBKDVOC-UHFFFAOYSA-N
Molecular Formula	C7H6FNO2

10,355

ICBA 98.5+%, TCI America™

CAS: 1207461-57-1 Molecular Formula: C78H16 Molecular Weight (g/mol): 952.986 MDL Number: MFCD20264904 InChI Key: HQCAMIYWHBVPQE-UHFFFAOYSA-N PubChem CID: 91972098 SMILES: C1C2C3=CC=CC=C3C1C45C26C7=C8C9=C1C2=C3C8=C8C6=C6C4=C4C%10=C%11C%12=C%13C%14=C%15C%16=C%17C(=C1C1=C2C2=C%18C%19=C%20C2=C3C8=C2C%20=C(C%10=C26)C2=C%11C3=C%13C%15=C6C%17=C1C%181C6(C3=C2%19)C2CC1C1=CC=CC=C21)C1=C%16C2=C%14C(=C%124)C5=C2C7=C19

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Specifications

PubChem CID	91972098
CAS	1207461-57-1
Molecular Weight (g/mol)	952.986
MDL Number	MFCD20264904
SMILES	C1C2C3=CC=CC=C3C1C45C26C7=C8C9=C1C2=C3C8=C8C6=C6C4=C4C%10=C%11C%12=C%13C%14=C%15C%16=C%17C(=C1C1=C2C2=C%18C%19=C%20C2=C3C8=C2C%20=C(C%10=C26)C2=C%11C3=C%13C%15=C6C%17=C1C%181C6(C3=C2%19)C2CC1C1=CC=CC=C21)C1=C%16C2=C%14C(=C%124)C5=C2C7=C19
InChI Key	HQCAMIYWHBVPQE-UHFFFAOYSA-N
Molecular Formula	C78H16

10,356

3,4-Benzopyrene (purified by sublimation) 95.0+%, TCI America™

CAS: 50-32-8 Molecular Formula: C20H12 Molecular Weight (g/mol): 252.32 MDL Number: MFCD00003602 InChI Key: FMMWHPNWAFZXNH-UHFFFAOYSA-N Synonym: benzo a pyrene,3,4-benzopyrene,benzo pqr tetraphene,3,4-benzpyrene,benzpyrene,benzo def chrysene,6,7-benzopyrene,benz a pyrene,3,4-benz a pyrene PubChem CID: 2336 ChEBI: CHEBI:29865 IUPAC Name: pentacyclo[10.6.2.0²,⁷.0⁹,¹⁹.0¹⁶,²⁰]icosa-1(18),2,4,6,8,10,12,14,16,19-decaene SMILES: C1=CC=C2C(=C1)C=C1C=CC3=CC=CC4=CC=C2C1=C34

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Specifications

PubChem CID	2336
CAS	50-32-8
Molecular Weight (g/mol)	252.32
ChEBI	CHEBI:29865
MDL Number	MFCD00003602
SMILES	C1=CC=C2C(=C1)C=C1C=CC3=CC=CC4=CC=C2C1=C34
Synonym	benzo a pyrene,3,4-benzopyrene,benzo pqr tetraphene,3,4-benzpyrene,benzpyrene,benzo def chrysene,6,7-benzopyrene,benz a pyrene,3,4-benz a pyrene
IUPAC Name	pentacyclo[10.6.2.0²,⁷.0⁹,¹⁹.0¹⁶,²⁰]icosa-1(18),2,4,6,8,10,12,14,16,19-decaene
InChI Key	FMMWHPNWAFZXNH-UHFFFAOYSA-N
Molecular Formula	C20H12

10,357

Coronene (purified by sublimation) 98.0+%, TCI America™

CAS: 191-07-1 Molecular Formula: C24H12 Molecular Weight (g/mol): 300.36 MDL Number: MFCD00004134 InChI Key: VPUGDVKSAQVFFS-UHFFFAOYSA-N Synonym: hexabenzobenzene,dibenzo ghi,pqr perylene,superbenzene,unii-7yy0x5xt1w,ccris 908,7yy0x5xt1w,6 circulene,coronene,acmc-209eul PubChem CID: 9115 ChEBI: CHEBI:29863 IUPAC Name: coronene SMILES: C1=CC2=CC=C3C=CC4=CC=C5C=CC6=CC=C1C1=C2C3=C4C5=C61

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Specifications

PubChem CID	9115
CAS	191-07-1
Molecular Weight (g/mol)	300.36
ChEBI	CHEBI:29863
MDL Number	MFCD00004134
SMILES	C1=CC2=CC=C3C=CC4=CC=C5C=CC6=CC=C1C1=C2C3=C4C5=C61
Synonym	hexabenzobenzene,dibenzo ghi,pqr perylene,superbenzene,unii-7yy0x5xt1w,ccris 908,7yy0x5xt1w,6 circulene,coronene,acmc-209eul
IUPAC Name	coronene
InChI Key	VPUGDVKSAQVFFS-UHFFFAOYSA-N
Molecular Formula	C24H12

10,358

3,6-Dibromo-9-(triphenylen-2-yl)carbazole 98.0+%, TCI America™

CAS: 1351870-16-0 Molecular Formula: C30H17Br2N Molecular Weight (g/mol): 551.281 InChI Key: SXVSFEPJEUWLCL-UHFFFAOYSA-N PubChem CID: 89492331 IUPAC Name: 3,6-dibromo-9-triphenylen-2-ylcarbazole SMILES: C1=CC=C2C(=C1)C3=C(C=C(C=C3)N4C5=C(C=C(C=C5)Br)C6=C4C=CC(=C6)Br)C7=CC=CC=C27

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Specifications

PubChem CID	89492331
CAS	1351870-16-0
Molecular Weight (g/mol)	551.281
SMILES	C1=CC=C2C(=C1)C3=C(C=C(C=C3)N4C5=C(C=C(C=C5)Br)C6=C4C=CC(=C6)Br)C7=CC=CC=C27
IUPAC Name	3,6-dibromo-9-triphenylen-2-ylcarbazole
InChI Key	SXVSFEPJEUWLCL-UHFFFAOYSA-N
Molecular Formula	C30H17Br2N

10,359

Carnosic Acid (Synthetic) 97.0+%, TCI America™

CAS: 3650-09-7 Molecular Formula: C20H28O4 Molecular Weight (g/mol): 332.44 MDL Number: MFCD02259459 InChI Key: QRYRORQUOLYVBU-VBKZILBWSA-N Synonym: (4aR,10aS)-5,6-Dihydroxy-7-isopropyl-1,1-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-4a-carboxylic Acid PubChem CID: 65126 ChEBI: CHEBI:65585 IUPAC Name: (4aR,10aS)-5,6-dihydroxy-1,1-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylic acid SMILES: CC(C)C1=C(C(=C2C(=C1)CCC3C2(CCCC3(C)C)C(=O)O)O)O

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Specifications

PubChem CID	65126
CAS	3650-09-7
Molecular Weight (g/mol)	332.44
ChEBI	CHEBI:65585
MDL Number	MFCD02259459
SMILES	CC(C)C1=C(C(=C2C(=C1)CCC3C2(CCCC3(C)C)C(=O)O)O)O
Synonym	(4aR,10aS)-5,6-Dihydroxy-7-isopropyl-1,1-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-4a-carboxylic Acid
IUPAC Name	(4aR,10aS)-5,6-dihydroxy-1,1-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-4a-carboxylic acid
InChI Key	QRYRORQUOLYVBU-VBKZILBWSA-N
Molecular Formula	C20H28O4

10,360

2,3,6,7,10,11-Hexamethoxytriphenylene 95.0+%, TCI America™

CAS: 808-57-1 Molecular Formula: C24H24O6 Molecular Weight (g/mol): 408.45 MDL Number: MFCD00075571 InChI Key: TXROZCSFVVIBFI-UHFFFAOYSA-N PubChem CID: 4607363 IUPAC Name: 2,3,6,7,10,11-hexamethoxytriphenylene SMILES: COC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)OC)OC)OC)OC)OC

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Specifications

PubChem CID	4607363
CAS	808-57-1
Molecular Weight (g/mol)	408.45
MDL Number	MFCD00075571
SMILES	COC1=C(C=C2C(=C1)C3=CC(=C(C=C3C4=CC(=C(C=C24)OC)OC)OC)OC)OC
IUPAC Name	2,3,6,7,10,11-hexamethoxytriphenylene
InChI Key	TXROZCSFVVIBFI-UHFFFAOYSA-N
Molecular Formula	C24H24O6

10,361

Dibenzo[b,def]chrysene 98.0+%, TCI America™

CAS: 189-64-0 Molecular Formula: C24H14 Molecular Weight (g/mol): 302.376 MDL Number: MFCD00039579 InChI Key: RXUSYFJGDZFVND-UHFFFAOYSA-N Synonym: dibenzo b,def chrysene,dibenzo a,h pyrene,db a,h p,3,4,8,9-dibenzpyrene,1,2,6,7-dibenzopyrene,3,4,8,9-dibenzopyrene,unii-xr5r3v8bjk,3,4:8,9-dibenzopyrene PubChem CID: 9108 ChEBI: CHEBI:82313 SMILES: C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C4C(=CC6=CC=CC=C56)C=C3

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Specifications

PubChem CID	9108
CAS	189-64-0
Molecular Weight (g/mol)	302.376
ChEBI	CHEBI:82313
MDL Number	MFCD00039579
SMILES	C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C4C(=CC6=CC=CC=C56)C=C3
Synonym	dibenzo b,def chrysene,dibenzo a,h pyrene,db a,h p,3,4,8,9-dibenzpyrene,1,2,6,7-dibenzopyrene,3,4,8,9-dibenzopyrene,unii-xr5r3v8bjk,3,4:8,9-dibenzopyrene
InChI Key	RXUSYFJGDZFVND-UHFFFAOYSA-N
Molecular Formula	C24H14

10,362

4,4,5,5-Tetramethyl-2-[3-(triphenylen-2-yl)phenyl]-1,3,2-dioxaborolane 98.0+%, TCI America™

CAS: 1115639-92-3 Molecular Formula: C30H27BO2 Molecular Weight (g/mol): 430.35 MDL Number: MFCD28130383 InChI Key: NZTBACVVLACPNL-UHFFFAOYSA-N Synonym: 2-[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]triphenylene PubChem CID: 58489416 IUPAC Name: 4,4,5,5-tetramethyl-2-[3-(triphenylen-2-yl)phenyl]-1,3,2-dioxaborolane SMILES: CC1(C)OB(OC1(C)C)C1=CC(=CC=C1)C1=CC=C2C3=CC=CC=C3C3=CC=CC=C3C2=C1

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Specifications

PubChem CID	58489416
CAS	1115639-92-3
Molecular Weight (g/mol)	430.35
MDL Number	MFCD28130383
SMILES	CC1(C)OB(OC1(C)C)C1=CC(=CC=C1)C1=CC=C2C3=CC=CC=C3C3=CC=CC=C3C2=C1
Synonym	2-[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]triphenylene
IUPAC Name	4,4,5,5-tetramethyl-2-[3-(triphenylen-2-yl)phenyl]-1,3,2-dioxaborolane
InChI Key	NZTBACVVLACPNL-UHFFFAOYSA-N
Molecular Formula	C30H27BO2

10,363

Dibenzo[g,p]chrysene 98.0+%, TCI America™

CAS: 191-68-4 Molecular Formula: C26H16 Molecular Weight (g/mol): 328.414 InChI Key: GQDKQZAEQBGVBS-UHFFFAOYSA-N PubChem CID: 67449 SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3C4=C2C5=CC=CC=C5C6=CC=CC=C64

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Specifications

PubChem CID	67449
CAS	191-68-4
Molecular Weight (g/mol)	328.414
SMILES	C1=CC=C2C(=C1)C3=CC=CC=C3C4=C2C5=CC=CC=C5C6=CC=CC=C64
InChI Key	GQDKQZAEQBGVBS-UHFFFAOYSA-N
Molecular Formula	C26H16

10,364

Sodium Abietate 95.0+%, TCI America™

CAS: 14351-66-7 Molecular Formula: C20H29NaO2 Molecular Weight (g/mol): 324.44 MDL Number: MFCD00058941 InChI Key: ITCAUAYQCALGGV-XTICBAGASA-M Synonym: Abietic Acid Sodium Salt PubChem CID: 133121851 IUPAC Name: sodium (1R,4aR,4bR,10aR)-1,4a-dimethyl-7-(propan-2-yl)-1,2,3,4,4a,4b,5,6,10,10a-decahydrophenanthrene-1-carboxylate SMILES: [Na+].CC(C)C1=CC2=CC[C@@H]3[C@](C)(CCC[C@@]3(C)C([O-])=O)[C@H]2CC1

Pricing & Availability
Specifications

PubChem CID	133121851
CAS	14351-66-7
Molecular Weight (g/mol)	324.44
MDL Number	MFCD00058941
SMILES	[Na+].CC(C)C1=CC2=CC[C@@H]3[C@](C)(CCC[C@@]3(C)C([O-])=O)[C@H]2CC1
Synonym	Abietic Acid Sodium Salt
IUPAC Name	sodium (1R,4aR,4bR,10aR)-1,4a-dimethyl-7-(propan-2-yl)-1,2,3,4,4a,4b,5,6,10,10a-decahydrophenanthrene-1-carboxylate
InChI Key	ITCAUAYQCALGGV-XTICBAGASA-M
Molecular Formula	C20H29NaO2

10,365

9,10-Dihydrophenanthrene 96.0+%, TCI America™

CAS: 776-35-2 Molecular Formula: C14H12 Molecular Weight (g/mol): 180.25 MDL Number: MFCD00001164 InChI Key: XXPBFNVKTVJZKF-UHFFFAOYSA-N Synonym: phenanthrene, 9,10-dihydro,unii-brm9tu2f34,9,10-dihydro-phenanthrene,dihydrophenanthrene,brm9tu2f34,acmc-1ba4q,phenanthrene,9,10-dihydro,9,10-dihydrophenanthrene,phenanthrene, 9,10-dihydro-8ci 9ci PubChem CID: 13058 IUPAC Name: 9,10-dihydrophenanthrene SMILES: C1CC2=CC=CC=C2C3=CC=CC=C31

Pricing & Availability
Specifications

PubChem CID	13058
CAS	776-35-2
Molecular Weight (g/mol)	180.25
MDL Number	MFCD00001164
SMILES	C1CC2=CC=CC=C2C3=CC=CC=C31
Synonym	phenanthrene, 9,10-dihydro,unii-brm9tu2f34,9,10-dihydro-phenanthrene,dihydrophenanthrene,brm9tu2f34,acmc-1ba4q,phenanthrene,9,10-dihydro,9,10-dihydrophenanthrene,phenanthrene, 9,10-dihydro-8ci 9ci
IUPAC Name	9,10-dihydrophenanthrene
InChI Key	XXPBFNVKTVJZKF-UHFFFAOYSA-N
Molecular Formula	C14H12

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