Unclassified Organic Compounds

Organic compounds that do not fit into any other organic chemical classification.

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3,481 – 3,495 of 162,937 results

3,481

Sucrose Fatty Acid Ester, TCI America™

MDL Number: MFCD00148531 Synonym: Fatty Acid Sucrose Ester, Saccharose Fatty Acid Ester

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MDL Number	MFCD00148531
Synonym	Fatty Acid Sucrose Ester, Saccharose Fatty Acid Ester

3,482

Glycidyl Stearate 96.0+%, TCI America™

CAS: 7460-84-6 Molecular Formula: C21H40O3 Molecular Weight (g/mol): 340.55 MDL Number: MFCD00059110 InChI Key: OUQGOXCIUOCDNN-UHFFFAOYNA-N Synonym: Stearic Acid Glycidyl Ester PubChem CID: 62642 ChEBI: CHEBI:82470 IUPAC Name: (oxiran-2-yl)methyl octadecanoate SMILES: CCCCCCCCCCCCCCCCCC(=O)OCC1CO1

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Specifications

PubChem CID	62642
CAS	7460-84-6
Molecular Weight (g/mol)	340.55
ChEBI	CHEBI:82470
MDL Number	MFCD00059110
SMILES	CCCCCCCCCCCCCCCCCC(=O)OCC1CO1
Synonym	Stearic Acid Glycidyl Ester
IUPAC Name	(oxiran-2-yl)methyl octadecanoate
InChI Key	OUQGOXCIUOCDNN-UHFFFAOYNA-N
Molecular Formula	C21H40O3

3,483

RuCl2[(S)-xylbinap][(S)-daipen], TCI America™

CAS: 220114-01-2 Molecular Formula: C71H74Cl2N2O2P2Ru MDL Number: MFCD09753027

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Specifications

CAS	220114-01-2
MDL Number	MFCD09753027
Molecular Formula	C71H74Cl2N2O2P2Ru

3,484

2-Adamantanone 98.0+%, TCI America™

CAS: 700-58-3 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.221 MDL Number: MFCD00074737 InChI Key: IYKFYARMMIESOX-UHFFFAOYSA-N Synonym: 2-adamantanone,adamantanone,2-adamantone,2-oxoadamantane,tricyclo 3.3.1.13,7 decanone,unii-ui7w503l08,tricyclo 3,3,1,13,7 decanone,tricyclo 3.3.1.1 sup 3,7 decanone,tricyclo 3.3.1.13,7 decan-2-one PubChem CID: 64151 ChEBI: CHEBI:40611 IUPAC Name: adamantan-2-one SMILES: C1C2CC3CC1CC(C2)C3=O

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Specifications

PubChem CID	64151
CAS	700-58-3
Molecular Weight (g/mol)	150.221
ChEBI	CHEBI:40611
MDL Number	MFCD00074737
SMILES	C1C2CC3CC1CC(C2)C3=O
Synonym	2-adamantanone,adamantanone,2-adamantone,2-oxoadamantane,tricyclo 3.3.1.13,7 decanone,unii-ui7w503l08,tricyclo 3,3,1,13,7 decanone,tricyclo 3.3.1.1 sup 3,7 decanone,tricyclo 3.3.1.13,7 decan-2-one
IUPAC Name	adamantan-2-one
InChI Key	IYKFYARMMIESOX-UHFFFAOYSA-N
Molecular Formula	C10H14O

3,485

2,6-Dibromo-4,8-bis[(2-butyl-n-octyl)oxy]benzo[1,2-b:4,5-b']dithiophene 94.0+%, TCI America™

CAS: 1336893-15-2 Molecular Formula: C34H52Br2O2S2 Molecular Weight (g/mol): 716.716 InChI Key: XXZPBOPQASGASH-UHFFFAOYSA-N PubChem CID: 118475389 IUPAC Name: 2,6-dibromo-4,8-bis(2-butyloctoxy)thieno[2,3-f][1]benzothiole SMILES: CCCCCCC(CCCC)COC1=C2C=C(SC2=C(C3=C1SC(=C3)Br)OCC(CCCC)CCCCCC)Br

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Specifications

PubChem CID	118475389
CAS	1336893-15-2
Molecular Weight (g/mol)	716.716
SMILES	CCCCCCC(CCCC)COC1=C2C=C(SC2=C(C3=C1SC(=C3)Br)OCC(CCCC)CCCCCC)Br
IUPAC Name	2,6-dibromo-4,8-bis(2-butyloctoxy)thieno[2,3-f][1]benzothiole
InChI Key	XXZPBOPQASGASH-UHFFFAOYSA-N
Molecular Formula	C34H52Br2O2S2

3,486

N-(tert-Butoxycarbonyl)-D-valine 98.0+%, TCI America™

CAS: 22838-58-0 Molecular Formula: C10H19NO4 Molecular Weight (g/mol): 217.27 MDL Number: MFCD00038282 InChI Key: SZXBQTSZISFIAO-SSDOTTSWSA-N Synonym: boc-d-valine,boc-d-val-oh,n-boc-d-valine,n-tert-butoxycarbonyl-d-valine,tert-butoxycarbonyl-d-valine,r-2-tert-butoxycarbonyl amino-3-methylbutanoic acid,d-valine, n-1,1-dimethylethoxy carbonyl,n-tert-butoxycarbonyl-d-valin,r-2-tert-butoxycarbonylamino-3-methylbutanoic acid,n-alpha-t-butyloxycarbonyl-d-valine PubChem CID: 637605 IUPAC Name: (2R)-2-{[(tert-butoxy)carbonyl]amino}-3-methylbutanoic acid SMILES: CC(C)[C@@H](NC(=O)OC(C)(C)C)C(O)=O

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Specifications

PubChem CID	637605
CAS	22838-58-0
Molecular Weight (g/mol)	217.27
MDL Number	MFCD00038282
SMILES	CC(C)[C@@H](NC(=O)OC(C)(C)C)C(O)=O
Synonym	boc-d-valine,boc-d-val-oh,n-boc-d-valine,n-tert-butoxycarbonyl-d-valine,tert-butoxycarbonyl-d-valine,r-2-tert-butoxycarbonyl amino-3-methylbutanoic acid,d-valine, n-1,1-dimethylethoxy carbonyl,n-tert-butoxycarbonyl-d-valin,r-2-tert-butoxycarbonylamino-3-methylbutanoic acid,n-alpha-t-butyloxycarbonyl-d-valine
IUPAC Name	(2R)-2-{[(tert-butoxy)carbonyl]amino}-3-methylbutanoic acid
InChI Key	SZXBQTSZISFIAO-SSDOTTSWSA-N
Molecular Formula	C10H19NO4

3,487

Methyl O-Acetylricinoleate 80.0+%, TCI America™

CAS: 140-03-4 Molecular Formula: C21H38O4 Molecular Weight (g/mol): 354.53 MDL Number: MFCD00026204 InChI Key: CMOYPQWMTBSLJK-KAMYIIQDNA-N Synonym: O-Acetylricinoleic Acid Methyl Ester, Methyl (Z)-12-Acetoxy-9-octadecenoate PubChem CID: 27396493 IUPAC Name: methyl (9Z)-12-(acetyloxy)octadec-9-enoate SMILES: CCCCCCC(C\C=C/CCCCCCCC(=O)OC)OC(C)=O

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Specifications

PubChem CID	27396493
CAS	140-03-4
Molecular Weight (g/mol)	354.53
MDL Number	MFCD00026204
SMILES	CCCCCCC(C\C=C/CCCCCCCC(=O)OC)OC(C)=O
Synonym	O-Acetylricinoleic Acid Methyl Ester, Methyl (Z)-12-Acetoxy-9-octadecenoate
IUPAC Name	methyl (9Z)-12-(acetyloxy)octadec-9-enoate
InChI Key	CMOYPQWMTBSLJK-KAMYIIQDNA-N
Molecular Formula	C21H38O4

3,488

N-[(S)-1-Ethoxycarbonyl-3-phenylpropyl]-L-alanine 98.0+%, TCI America™

CAS: 82717-96-2 Molecular Formula: C15H21NO4 Molecular Weight (g/mol): 279.34 MDL Number: MFCD00209976 InChI Key: CEIWXEQZZZHLDM-AAEUAGOBSA-N Synonym: s-2-s-1-ethoxy-1-oxo-4-phenylbutan-2-yl amino propanoic acid,n-s-1-ethoxycarbonyl-3-phenylpropyl-l-alanine,unii-10sz4ij77b,n-1 s-ethoxycarbonyl-3-phenylpropyl-l-alanine,n-s-+-1-ethoxycarbonyl-3-phenylpropyl-l-alanine,2s-2-2s-1-ethoxy-1-oxo-4-phenylbutan-2-yl amino propanoic acid,s,s-n-ethoxy carbonyl-3-phenylpropyl alanine,n-s-1-carboxyethyl-l-homophenylalanine ethyl ester,s,s-n-1-ethoxycarbonyl-3-phenylpropyl alanine PubChem CID: 5702571 IUPAC Name: (2S)-2-{[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino}propanoic acid SMILES: CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(O)=O

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Specifications

PubChem CID	5702571
CAS	82717-96-2
Molecular Weight (g/mol)	279.34
MDL Number	MFCD00209976
SMILES	CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(O)=O
Synonym	s-2-s-1-ethoxy-1-oxo-4-phenylbutan-2-yl amino propanoic acid,n-s-1-ethoxycarbonyl-3-phenylpropyl-l-alanine,unii-10sz4ij77b,n-1 s-ethoxycarbonyl-3-phenylpropyl-l-alanine,n-s-+-1-ethoxycarbonyl-3-phenylpropyl-l-alanine,2s-2-2s-1-ethoxy-1-oxo-4-phenylbutan-2-yl amino propanoic acid,s,s-n-ethoxy carbonyl-3-phenylpropyl alanine,n-s-1-carboxyethyl-l-homophenylalanine ethyl ester,s,s-n-1-ethoxycarbonyl-3-phenylpropyl alanine
IUPAC Name	(2S)-2-{[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino}propanoic acid
InChI Key	CEIWXEQZZZHLDM-AAEUAGOBSA-N
Molecular Formula	C15H21NO4

3,489

Ethylenediaminetetraacetic Acid Disodium Cobalt Salt Hydrate 98.0+%, TCI America™

CAS: 15137-09-4 Molecular Formula: C10H14CoN2Na2O8 Molecular Weight (g/mol): 395.14 MDL Number: MFCD00661153 InChI Key: BVGFHSPTZBVUQN-UHFFFAOYSA-L Synonym: Cobalt Disodium Ethylenediaminetetraacetate PubChem CID: 131700210 IUPAC Name: λ²-cobalt(2+) disodium hydrogen 2-[(carboxylatomethyl)({2-[(carboxylatomethyl)(hydrogen carboxylatomethyl)amino]ethyl})amino]ethanehydrogen carboxylate SMILES: [Na+].[Na+].[Co++].[O-]C(=O)CN(CCN(CC([O-])=O)CC([OH-])=O)CC([OH-])=O

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Specifications

PubChem CID	131700210
CAS	15137-09-4
Molecular Weight (g/mol)	395.14
MDL Number	MFCD00661153
SMILES	[Na+].[Na+].[Co++].[O-]C(=O)CN(CCN(CC([O-])=O)CC([OH-])=O)CC([OH-])=O
Synonym	Cobalt Disodium Ethylenediaminetetraacetate
IUPAC Name	λ²-cobalt(2+) disodium hydrogen 2-[(carboxylatomethyl)({2-[(carboxylatomethyl)(hydrogen carboxylatomethyl)amino]ethyl})amino]ethanehydrogen carboxylate
InChI Key	BVGFHSPTZBVUQN-UHFFFAOYSA-L
Molecular Formula	C10H14CoN2Na2O8

3,490

O-Benzyl-L-serine Methyl Ester Hydrochloride 98.0+%, TCI America™

CAS: 19525-87-2 Molecular Formula: C11H16ClNO3 Molecular Weight (g/mol): 245.70 MDL Number: MFCD00191312 InChI Key: UDHSAWHYRXHQJP-UHFFFAOYNA-N Synonym: Methyl O-Benzyl-L-serinate Hydrochloride, H-Ser(Bzl)-OMe.HCl PubChem CID: 44630138 IUPAC Name: methyl 2-amino-3-(benzyloxy)propanoate hydrochloride SMILES: Cl.COC(=O)C(N)COCC1=CC=CC=C1

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Specifications

PubChem CID	44630138
CAS	19525-87-2
Molecular Weight (g/mol)	245.70
MDL Number	MFCD00191312
SMILES	Cl.COC(=O)C(N)COCC1=CC=CC=C1
Synonym	Methyl O-Benzyl-L-serinate Hydrochloride, H-Ser(Bzl)-OMe.HCl
IUPAC Name	methyl 2-amino-3-(benzyloxy)propanoate hydrochloride
InChI Key	UDHSAWHYRXHQJP-UHFFFAOYNA-N
Molecular Formula	C11H16ClNO3

3,491

DL-Homocysteic Acid 97.0+%, TCI America™

CAS: 504-33-6 Molecular Formula: C4H9NO5S Molecular Weight (g/mol): 183.178 MDL Number: MFCD00007536 InChI Key: VBOQYPQEPHKASR-UHFFFAOYSA-N Synonym: dl-homocysteic acid,homocysteic acid,dl-homocysteicacid,2-amino-4-sulfobutyric acid,d,l-homocysteic acid,pubchem12443,acmc-1ap11,2-amino-4-sulfo-butanoic acid,dl-2-amino-4-sulfobutyric acid PubChem CID: 92117 IUPAC Name: 2-amino-4-sulfobutanoic acid SMILES: C(CS(=O)(=O)O)C(C(=O)O)N

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Specifications

PubChem CID	92117
CAS	504-33-6
Molecular Weight (g/mol)	183.178
MDL Number	MFCD00007536
SMILES	C(CS(=O)(=O)O)C(C(=O)O)N
Synonym	dl-homocysteic acid,homocysteic acid,dl-homocysteicacid,2-amino-4-sulfobutyric acid,d,l-homocysteic acid,pubchem12443,acmc-1ap11,2-amino-4-sulfo-butanoic acid,dl-2-amino-4-sulfobutyric acid
IUPAC Name	2-amino-4-sulfobutanoic acid
InChI Key	VBOQYPQEPHKASR-UHFFFAOYSA-N
Molecular Formula	C4H9NO5S

3,492

DBD-COCl 93.0+%, TCI America™

CAS: 156153-43-4 Molecular Formula: C11H13ClN4O4S Molecular Weight (g/mol): 332.759 MDL Number: MFCD00191377 InChI Key: NAIIBGUHMHXMNS-UHFFFAOYSA-N Synonym: 4-(N,N-Dimethylaminosulfonyl)-7-(N-chloroformylmethyl-N-methylamino)benzofurazan, 4-(N,N-Dimethylaminosulfonyl)-7-(N-chloroformylmethyl-N-methylamino)-2,1,3-benzoxadiazole PubChem CID: 133003 IUPAC Name: 2-[[4-(dimethylsulfamoyl)-2,1,3-benzoxadiazol-7-yl]-methylamino]acetyl chloride SMILES: CN(C)S(=O)(=O)C1=CC=C(C2=NON=C12)N(C)CC(=O)Cl

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Specifications

PubChem CID	133003
CAS	156153-43-4
Molecular Weight (g/mol)	332.759
MDL Number	MFCD00191377
SMILES	CN(C)S(=O)(=O)C1=CC=C(C2=NON=C12)N(C)CC(=O)Cl
Synonym	4-(N,N-Dimethylaminosulfonyl)-7-(N-chloroformylmethyl-N-methylamino)benzofurazan, 4-(N,N-Dimethylaminosulfonyl)-7-(N-chloroformylmethyl-N-methylamino)-2,1,3-benzoxadiazole
IUPAC Name	2-[[4-(dimethylsulfamoyl)-2,1,3-benzoxadiazol-7-yl]-methylamino]acetyl chloride
InChI Key	NAIIBGUHMHXMNS-UHFFFAOYSA-N
Molecular Formula	C11H13ClN4O4S

3,493

5-Ethyl L-Glutamate 97.0+%, TCI America™

CAS: 1119-33-1 Molecular Formula: C7H13NO4 Molecular Weight (g/mol): 175.18 MDL Number: MFCD00037217 InChI Key: XMQUEQJCYRFIQS-UHFFFAOYNA-N Synonym: h-glu oet-oh,l-glutamic acid 5-ethyl ester,l-glutamic acid gamma-ethyl ester,ethyl glutamate,unii-3ec85nwr4k,5-ethyl-l-glutamate,s-2-amino-5-ethoxy-5-oxopentanoic acid,2s-2-amino-5-ethoxy-5-oxopentanoic acid,3ec85nwr4k,l-glutamic acid-5-ethyl ester PubChem CID: 3082305 IUPAC Name: 2-amino-5-ethoxy-5-oxopentanoic acid SMILES: CCOC(=O)CCC(N)C(O)=O

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Specifications

PubChem CID	3082305
CAS	1119-33-1
Molecular Weight (g/mol)	175.18
MDL Number	MFCD00037217
SMILES	CCOC(=O)CCC(N)C(O)=O
Synonym	h-glu oet-oh,l-glutamic acid 5-ethyl ester,l-glutamic acid gamma-ethyl ester,ethyl glutamate,unii-3ec85nwr4k,5-ethyl-l-glutamate,s-2-amino-5-ethoxy-5-oxopentanoic acid,2s-2-amino-5-ethoxy-5-oxopentanoic acid,3ec85nwr4k,l-glutamic acid-5-ethyl ester
IUPAC Name	2-amino-5-ethoxy-5-oxopentanoic acid
InChI Key	XMQUEQJCYRFIQS-UHFFFAOYNA-N
Molecular Formula	C7H13NO4

3,494

AlkylFluor(TM) 97.0+%, TCI America™

CAS: 2043361-32-4 Molecular Formula: C27H36BF5N2 Molecular Weight (g/mol): 494.401 InChI Key: ZXIKPDSPOFQTLH-UHFFFAOYSA-N Synonym: 1,3-Bis(2,6-diisopropylphenyl)-2-fluoroimidazolium Tetrafluoroborate PubChem CID: 124203184 IUPAC Name: 1,3-bis[2,6-di(propan-2-yl)phenyl]-2-fluoroimidazol-1-ium;tetrafluoroborate SMILES: [B-](F)(F)(F)F.CC(C)C1=C(C(=CC=C1)C(C)C)N2C=C[N+](=C2F)C3=C(C=CC=C3C(C)C)C(C)C

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Specifications

PubChem CID	124203184
CAS	2043361-32-4
Molecular Weight (g/mol)	494.401
SMILES	[B-](F)(F)(F)F.CC(C)C1=C(C(=CC=C1)C(C)C)N2C=C[N+](=C2F)C3=C(C=CC=C3C(C)C)C(C)C
Synonym	1,3-Bis(2,6-diisopropylphenyl)-2-fluoroimidazolium Tetrafluoroborate
IUPAC Name	1,3-bis[2,6-di(propan-2-yl)phenyl]-2-fluoroimidazol-1-ium;tetrafluoroborate
InChI Key	ZXIKPDSPOFQTLH-UHFFFAOYSA-N
Molecular Formula	C27H36BF5N2

3,495

trans-1,3-Cyclohexanediol 98.0+%, TCI America™

CAS: 5515-64-0 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00039458,MFCD16295186 InChI Key: RLMGYIOTPQVQJR-UHFFFAOYNA-N Synonym: trans-1,3-Dihydroxycyclohexane PubChem CID: 6950744 IUPAC Name: cyclohexane-1,3-diol SMILES: OC1CCCC(O)C1

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Specifications

PubChem CID	6950744
CAS	5515-64-0
Molecular Weight (g/mol)	116.16
MDL Number	MFCD00039458,MFCD16295186
SMILES	OC1CCCC(O)C1
Synonym	trans-1,3-Dihydroxycyclohexane
IUPAC Name	cyclohexane-1,3-diol
InChI Key	RLMGYIOTPQVQJR-UHFFFAOYNA-N
Molecular Formula	C6H12O2

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