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Organic compounds

Organic compounds are a class of chemical compounds that contain one or more atoms of carbon covalently bonded to each other and atoms of other elements such as hydrogen, oxygen, nitrogen, sulfur, etc.

Compounds or allotropes of carbon that contain only carbon atoms are classified as inorganic compounds and exhibit novel properties.

This class of chemicals has a wide range of applications and includes graphite, diamond, and the more recently discovered graphene, fullerenes, and other carbon nanotubes. In fact, the majority of elements in the periodic table of elements are inorganic compounds.

Unclassified Organic Compounds (479)
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1

Spectrum Chemical Manufacturing Corporation Diethylenetriaminepentaacetic Acid, Pentasodium Salt, 41% Solution in Water, Spectrum™ Chemical
SDP

CAS: 140-01-2 Molecular Formula: C14H18N3Na5O10 Molecular Weight (g/mol): 503.26 MDL Number: MFCD00051016 InChI Key: LQPLDXQVILYOOL-UHFFFAOYSA-I IUPAC Name: pentasodium 2-[bis({2-[bis(carboxylatomethyl)amino]ethyl})amino]acetate SMILES: [Na+].[Na+].[Na+].[Na+].[Na+].[O-]C(=O)CN(CCN(CC([O-])=O)CC([O-])=O)CCN(CC([O-])=O)CC([O-])=O

CAS 140-01-2
Molecular Weight (g/mol) 503.26
MDL Number MFCD00051016
SMILES [Na+].[Na+].[Na+].[Na+].[Na+].[O-]C(=O)CN(CCN(CC([O-])=O)CC([O-])=O)CCN(CC([O-])=O)CC([O-])=O
IUPAC Name pentasodium 2-[bis({2-[bis(carboxylatomethyl)amino]ethyl})amino]acetate
InChI Key LQPLDXQVILYOOL-UHFFFAOYSA-I
Molecular Formula C14H18N3Na5O10
2

Dichloromethane, anhydrous, 99.7+%, packaged under Argon in resealable ChemSeal™ bottles, stab. with amylene

CAS: 75-09-2 Molecular Formula: CH2Cl2 Molecular Weight (g/mol): 84.93 MDL Number: MFCD00000881 InChI Key: YMWUJEATGCHHMB-UHFFFAOYSA-N Synonym: methylene chloride,methylene dichloride,methane, dichloro,methylene bichloride,methane dichloride,solaesthin,solmethine,freon 30,narkotil,aerothene mm PubChem CID: 6344 ChEBI: CHEBI:15767 IUPAC Name: dichloromethane SMILES: ClCCl

PubChem CID 6344
CAS 75-09-2
Molecular Weight (g/mol) 84.93
ChEBI CHEBI:15767
MDL Number MFCD00000881
SMILES ClCCl
Synonym methylene chloride,methylene dichloride,methane, dichloro,methylene bichloride,methane dichloride,solaesthin,solmethine,freon 30,narkotil,aerothene mm
IUPAC Name dichloromethane
InChI Key YMWUJEATGCHHMB-UHFFFAOYSA-N
Molecular Formula CH2Cl2
3

Caffeic Acid 98.0+%, TCI America™

CAS: 331-39-5 Molecular Formula: C9H8O4 Molecular Weight (g/mol): 180.159 MDL Number: MFCD00004392 InChI Key: QAIPRVGONGVQAS-DUXPYHPUSA-N Synonym: caffeic acid,3,4-dihydroxycinnamic acid,3-3,4-dihydroxyphenyl acrylic acid,trans-caffeate,3,4-dihydroxy-trans-cinnamate,2e-3-3,4-dihydroxyphenyl prop-2-enoic acid,3,4-dihydroxybenzeneacrylic acid,e-3-3,4-dihydroxyphenyl acrylic acid,trans-caffeic acid,3-3,4-dihydroxyphenyl propenoic acid PubChem CID: 689043 ChEBI: CHEBI:16433 IUPAC Name: (E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid SMILES: C1=CC(=C(C=C1C=CC(=O)O)O)O

PubChem CID 689043
CAS 331-39-5
Molecular Weight (g/mol) 180.159
ChEBI CHEBI:16433
MDL Number MFCD00004392
SMILES C1=CC(=C(C=C1C=CC(=O)O)O)O
Synonym caffeic acid,3,4-dihydroxycinnamic acid,3-3,4-dihydroxyphenyl acrylic acid,trans-caffeate,3,4-dihydroxy-trans-cinnamate,2e-3-3,4-dihydroxyphenyl prop-2-enoic acid,3,4-dihydroxybenzeneacrylic acid,e-3-3,4-dihydroxyphenyl acrylic acid,trans-caffeic acid,3-3,4-dihydroxyphenyl propenoic acid
IUPAC Name (E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid
InChI Key QAIPRVGONGVQAS-DUXPYHPUSA-N
Molecular Formula C9H8O4
4

3,4-Dimethylbenzophenone 98.0+%, TCI America™

CAS: 2571-39-3 Molecular Formula: C15H14O Molecular Weight (g/mol): 210.28 MDL Number: MFCD00008525 InChI Key: JENOLWCGNVWTJN-UHFFFAOYSA-N Synonym: 3,4-dimethylbenzophenone,3,4-dimethylphenyl phenyl methanone,methanone, 3,4-dimethylphenyl phenyl,3,4-dimethylphenyl-phenylmethanone,3,4-dimethylphenyl phenyl ketone,acmc-1cbaf,3,4-dimethyl-benzophenone,ksc490c7t,benzophenone, 3,4-dimethyl PubChem CID: 75730 IUPAC Name: (3,4-dimethylphenyl)(phenyl)methanone SMILES: CC1=CC=C(C=C1C)C(=O)C1=CC=CC=C1

PubChem CID 75730
CAS 2571-39-3
Molecular Weight (g/mol) 210.28
MDL Number MFCD00008525
SMILES CC1=CC=C(C=C1C)C(=O)C1=CC=CC=C1
Synonym 3,4-dimethylbenzophenone,3,4-dimethylphenyl phenyl methanone,methanone, 3,4-dimethylphenyl phenyl,3,4-dimethylphenyl-phenylmethanone,3,4-dimethylphenyl phenyl ketone,acmc-1cbaf,3,4-dimethyl-benzophenone,ksc490c7t,benzophenone, 3,4-dimethyl
IUPAC Name (3,4-dimethylphenyl)(phenyl)methanone
InChI Key JENOLWCGNVWTJN-UHFFFAOYSA-N
Molecular Formula C15H14O
5

Decafluorobenzophenone 98.0+%, TCI America™

CAS: 853-39-4 Molecular Formula: C13F10O Molecular Weight (g/mol): 362.126 MDL Number: MFCD00000295 InChI Key: WWQLXRAKBJVNCC-UHFFFAOYSA-N Synonym: decafluorobenzophenone,benzophenone, decafluoro,perfluorobenzophenone,methanone, bis pentafluorophenyl,bis perfluorophenyl methanone,bis pentafluorophenyl methanone,bis 2,3,4,5,6-pentafluorophenyl methanone,di2,3,4,5,6-pentafluorophenyl ketone,acmc-209q5n PubChem CID: 70068 IUPAC Name: bis(2,3,4,5,6-pentafluorophenyl)methanone SMILES: C1(=C(C(=C(C(=C1F)F)F)F)F)C(=O)C2=C(C(=C(C(=C2F)F)F)F)F

PubChem CID 70068
CAS 853-39-4
Molecular Weight (g/mol) 362.126
MDL Number MFCD00000295
SMILES C1(=C(C(=C(C(=C1F)F)F)F)F)C(=O)C2=C(C(=C(C(=C2F)F)F)F)F
Synonym decafluorobenzophenone,benzophenone, decafluoro,perfluorobenzophenone,methanone, bis pentafluorophenyl,bis perfluorophenyl methanone,bis pentafluorophenyl methanone,bis 2,3,4,5,6-pentafluorophenyl methanone,di2,3,4,5,6-pentafluorophenyl ketone,acmc-209q5n
IUPAC Name bis(2,3,4,5,6-pentafluorophenyl)methanone
InChI Key WWQLXRAKBJVNCC-UHFFFAOYSA-N
Molecular Formula C13F10O
6

4-Hydroxyphenylpyruvic Acid 95.0+%, TCI America™

CAS: 156-39-8 Molecular Formula: C9H8O4 Molecular Weight (g/mol): 180.159 MDL Number: MFCD00002591 InChI Key: KKADPXVIOXHVKN-UHFFFAOYSA-N Synonym: 4-hydroxyphenylpyruvic acid,testacid,3-4-hydroxyphenyl-2-oxopropanoic acid,p-hydroxyphenylpyruvic acid,testacide,4-hydroxyphenylpyruvate,3-4-hydroxyphenyl pyruvic acid,p-hydroxyphenyl pyruvic acid,3-p-hydroxyphenyl pyruvic acid,3-p-hydroxyphenyl-2-oxopropanoic acid PubChem CID: 979 ChEBI: CHEBI:15999 IUPAC Name: 3-(4-hydroxyphenyl)-2-oxopropanoic acid SMILES: C1=CC(=CC=C1CC(=O)C(=O)O)O

PubChem CID 979
CAS 156-39-8
Molecular Weight (g/mol) 180.159
ChEBI CHEBI:15999
MDL Number MFCD00002591
SMILES C1=CC(=CC=C1CC(=O)C(=O)O)O
Synonym 4-hydroxyphenylpyruvic acid,testacid,3-4-hydroxyphenyl-2-oxopropanoic acid,p-hydroxyphenylpyruvic acid,testacide,4-hydroxyphenylpyruvate,3-4-hydroxyphenyl pyruvic acid,p-hydroxyphenyl pyruvic acid,3-p-hydroxyphenyl pyruvic acid,3-p-hydroxyphenyl-2-oxopropanoic acid
IUPAC Name 3-(4-hydroxyphenyl)-2-oxopropanoic acid
InChI Key KKADPXVIOXHVKN-UHFFFAOYSA-N
Molecular Formula C9H8O4
8

4-Methylcinnamic Acid 98.0+%, TCI America™

CAS: 1866-39-3 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.188 MDL Number: MFCD00002697 InChI Key: RURHILYUWQEGOS-VOTSOKGWSA-N Synonym: 4-methylcinnamic acid,3-p-tolyl acrylic acid,e-3-p-tolyl acrylic acid,p-methylcinnamic acid,p-methyl cinnamic acid,2e-3-4-methylphenyl acrylic acid,2e-3-4-methylphenyl prop-2-enoic acid,4-methyl-cinnamic acid,e-3-4-methylphenyl-2-propenoic acid,3-4-methylphenyl-2-propenoic acid PubChem CID: 731767 IUPAC Name: (E)-3-(4-methylphenyl)prop-2-enoic acid SMILES: CC1=CC=C(C=C1)C=CC(=O)O

PubChem CID 731767
CAS 1866-39-3
Molecular Weight (g/mol) 162.188
MDL Number MFCD00002697
SMILES CC1=CC=C(C=C1)C=CC(=O)O
Synonym 4-methylcinnamic acid,3-p-tolyl acrylic acid,e-3-p-tolyl acrylic acid,p-methylcinnamic acid,p-methyl cinnamic acid,2e-3-4-methylphenyl acrylic acid,2e-3-4-methylphenyl prop-2-enoic acid,4-methyl-cinnamic acid,e-3-4-methylphenyl-2-propenoic acid,3-4-methylphenyl-2-propenoic acid
IUPAC Name (E)-3-(4-methylphenyl)prop-2-enoic acid
InChI Key RURHILYUWQEGOS-VOTSOKGWSA-N
Molecular Formula C10H10O2
9

3,5-Difluoroaniline 98.0+%, TCI America™

CAS: 372-39-4 Molecular Formula: C6H5F2N Molecular Weight (g/mol): 129.11 MDL Number: MFCD00007763 InChI Key: KQOIBXZRCYFZSO-UHFFFAOYSA-N Synonym: benzenamine, 3,5-difluoro,3,5-difluorobenzenamine,3,5-difluorophenylamine,5an,3,5-difluoranilin,3,5-difluoroanilin,3,5 difluoroaniline,3.5-difluoroaniline,pubchem2296,3, 5-difluoroaniline PubChem CID: 96595 IUPAC Name: 3,5-difluoroaniline SMILES: C1=C(C=C(C=C1F)F)N

PubChem CID 96595
CAS 372-39-4
Molecular Weight (g/mol) 129.11
MDL Number MFCD00007763
SMILES C1=C(C=C(C=C1F)F)N
Synonym benzenamine, 3,5-difluoro,3,5-difluorobenzenamine,3,5-difluorophenylamine,5an,3,5-difluoranilin,3,5-difluoroanilin,3,5 difluoroaniline,3.5-difluoroaniline,pubchem2296,3, 5-difluoroaniline
IUPAC Name 3,5-difluoroaniline
InChI Key KQOIBXZRCYFZSO-UHFFFAOYSA-N
Molecular Formula C6H5F2N
10

m-Cresol 98.0+%, TCI America™

CAS: 108-39-4 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00002302 InChI Key: RLSSMJSEOOYNOY-UHFFFAOYSA-N Synonym: m-cresol,metacresol,meta-cresol,phenol, 3-methyl,3-hydroxytoluene,m-methylphenol,3-cresol,m-kresol,m-oxytoluene,m-toluol PubChem CID: 342 ChEBI: CHEBI:17231 IUPAC Name: 3-methylphenol SMILES: CC1=CC(=CC=C1)O

PubChem CID 342
CAS 108-39-4
Molecular Weight (g/mol) 108.14
ChEBI CHEBI:17231
MDL Number MFCD00002302
SMILES CC1=CC(=CC=C1)O
Synonym m-cresol,metacresol,meta-cresol,phenol, 3-methyl,3-hydroxytoluene,m-methylphenol,3-cresol,m-kresol,m-oxytoluene,m-toluol
IUPAC Name 3-methylphenol
InChI Key RLSSMJSEOOYNOY-UHFFFAOYSA-N
Molecular Formula C7H8O
11

5-Hydroxy-1,4-naphthoquinone 96.0+%, TCI America™

CAS: 481-39-0 Molecular Formula: C10H6O3 Molecular Weight (g/mol): 174.16 MDL Number: MFCD00001684 InChI Key: KQPYUDDGWXQXHS-UHFFFAOYSA-N Synonym: juglone,5-hydroxy-1,4-naphthoquinone,5-hydroxy-1,4-naphthalenedione,regianin,walnut extract,juglon,nucin,5-hydroxynaphthoquinone,akhnot,yuglon PubChem CID: 3806 ChEBI: CHEBI:15794 IUPAC Name: 5-hydroxy-1,4-dihydronaphthalene-1,4-dione SMILES: OC1=CC=CC2=C1C(=O)C=CC2=O

PubChem CID 3806
CAS 481-39-0
Molecular Weight (g/mol) 174.16
ChEBI CHEBI:15794
MDL Number MFCD00001684
SMILES OC1=CC=CC2=C1C(=O)C=CC2=O
Synonym juglone,5-hydroxy-1,4-naphthoquinone,5-hydroxy-1,4-naphthalenedione,regianin,walnut extract,juglon,nucin,5-hydroxynaphthoquinone,akhnot,yuglon
IUPAC Name 5-hydroxy-1,4-dihydronaphthalene-1,4-dione
InChI Key KQPYUDDGWXQXHS-UHFFFAOYSA-N
Molecular Formula C10H6O3
12

4-Methylthio-2-butanone 97.0+%, TCI America™

CAS: 34047-39-7 Molecular Formula: C5H10OS Molecular Weight (g/mol): 118.194 MDL Number: MFCD00040029 InChI Key: DRGHCRKOWMAZAO-UHFFFAOYSA-N Synonym: 4-methylthio-2-butanone,2-butanone, 4-methylthio,4-methylthio butan-2-one,unii-5703w1o1ab,4-methylsulfanyl butan-2-one,potato butanone,fema no. 3375,5-thiahexane-2-one,acmc-1afub PubChem CID: 61922 IUPAC Name: 4-methylsulfanylbutan-2-one SMILES: CC(=O)CCSC

PubChem CID 61922
CAS 34047-39-7
Molecular Weight (g/mol) 118.194
MDL Number MFCD00040029
SMILES CC(=O)CCSC
Synonym 4-methylthio-2-butanone,2-butanone, 4-methylthio,4-methylthio butan-2-one,unii-5703w1o1ab,4-methylsulfanyl butan-2-one,potato butanone,fema no. 3375,5-thiahexane-2-one,acmc-1afub
IUPAC Name 4-methylsulfanylbutan-2-one
InChI Key DRGHCRKOWMAZAO-UHFFFAOYSA-N
Molecular Formula C5H10OS
13

4-Bromobenz[a]anthracene 97.0+%, TCI America™

CAS: 61921-39-9 Molecular Formula: C18H11Br Molecular Weight (g/mol): 307.19 MDL Number: MFCD25371993 InChI Key: ILVKEMDEUCXCAB-UHFFFAOYSA-N Synonym: 4-Bromotetraphene PubChem CID: 182324 IUPAC Name: 4-bromobenzo[a]anthracene SMILES: C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C=CC=C4Br

PubChem CID 182324
CAS 61921-39-9
Molecular Weight (g/mol) 307.19
MDL Number MFCD25371993
SMILES C1=CC=C2C=C3C(=CC2=C1)C=CC4=C3C=CC=C4Br
Synonym 4-Bromotetraphene
IUPAC Name 4-bromobenzo[a]anthracene
InChI Key ILVKEMDEUCXCAB-UHFFFAOYSA-N
Molecular Formula C18H11Br
14

(4-Chlorobenzyl)triphenylphosphonium Chloride 98.0+%, TCI America™

CAS: 1530-39-8 Molecular Formula: C25H21Cl2P Molecular Weight (g/mol): 423.32 MDL Number: MFCD00041533 InChI Key: RAHOAHBOOHXRDY-UHFFFAOYSA-M Synonym: 4-chlorobenzyl triphenylphosphonium chloride,4-chlorobenzyl triphenylphosphoniumchloride,4-chlorophenyl methyl triphenylphosphanium chloride,acmc-1bpq8,4-chlorobenzyltriphenylphosphonium chloride,4-chlorobenzyltriphenyl-phosphonium chloride,4-chlorophenyl methyl-triphenylphosphanium chloride,4-chlorophenyl methyl-triphenylphosphonium chloride,4-chlorophenyl methyl triphenylphosphine, chloride,4-chlorobenzyl triphenyl phosphonium chloride PubChem CID: 2733546 IUPAC Name: [(4-chlorophenyl)methyl]triphenylphosphanium chloride SMILES: [Cl-].ClC1=CC=C(C[P+](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1

PubChem CID 2733546
CAS 1530-39-8
Molecular Weight (g/mol) 423.32
MDL Number MFCD00041533
SMILES [Cl-].ClC1=CC=C(C[P+](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1
Synonym 4-chlorobenzyl triphenylphosphonium chloride,4-chlorobenzyl triphenylphosphoniumchloride,4-chlorophenyl methyl triphenylphosphanium chloride,acmc-1bpq8,4-chlorobenzyltriphenylphosphonium chloride,4-chlorobenzyltriphenyl-phosphonium chloride,4-chlorophenyl methyl-triphenylphosphanium chloride,4-chlorophenyl methyl-triphenylphosphonium chloride,4-chlorophenyl methyl triphenylphosphine, chloride,4-chlorobenzyl triphenyl phosphonium chloride
IUPAC Name [(4-chlorophenyl)methyl]triphenylphosphanium chloride
InChI Key RAHOAHBOOHXRDY-UHFFFAOYSA-M
Molecular Formula C25H21Cl2P
15

4-Bromo-2-tert-butylphenol 95.0+%, TCI America™

CAS: 10323-39-4 Molecular Formula: C10H13BrO Molecular Weight (g/mol): 229.12 MDL Number: MFCD00192645 InChI Key: IKMJSWBFODAWTC-UHFFFAOYSA-N PubChem CID: 97068 IUPAC Name: 4-bromo-2-tert-butylphenol SMILES: CC(C)(C)C1=CC(Br)=CC=C1O

PubChem CID 97068
CAS 10323-39-4
Molecular Weight (g/mol) 229.12
MDL Number MFCD00192645
SMILES CC(C)(C)C1=CC(Br)=CC=C1O
IUPAC Name 4-bromo-2-tert-butylphenol
InChI Key IKMJSWBFODAWTC-UHFFFAOYSA-N
Molecular Formula C10H13BrO