Unclassified Organic Compounds

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

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691 – 705 of 205,643 results

691

N-Benzylglycine ethyl ester, 96%

CAS: 6436-90-4 Molecular Formula: C11H15NO2 Molecular Weight (g/mol): 193.25 MDL Number: MFCD00009174 InChI Key: ULOLIZHBYWAICY-UHFFFAOYSA-N Synonym: n-benzylglycine ethyl ester,ethyl 2-benzylamino acetate,ethyl n-benzylglycinate,n-bzl-gly-oet,bzl-gly-oet,glycine, n-phenylmethyl-, ethyl ester,n-benzyl glycine ethyl ester,ethyl n-phenylmethyl glycinate,ethyl benzylamino acetate,n-benzyl-glycine ethyl ester PubChem CID: 80908 IUPAC Name: ethyl 2-(benzylamino)acetate SMILES: CCOC(=O)CNCC1=CC=CC=C1

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Specifications

PubChem CID	80908
CAS	6436-90-4
Molecular Weight (g/mol)	193.25
MDL Number	MFCD00009174
SMILES	CCOC(=O)CNCC1=CC=CC=C1
Synonym	n-benzylglycine ethyl ester,ethyl 2-benzylamino acetate,ethyl n-benzylglycinate,n-bzl-gly-oet,bzl-gly-oet,glycine, n-phenylmethyl-, ethyl ester,n-benzyl glycine ethyl ester,ethyl n-phenylmethyl glycinate,ethyl benzylamino acetate,n-benzyl-glycine ethyl ester
IUPAC Name	ethyl 2-(benzylamino)acetate
InChI Key	ULOLIZHBYWAICY-UHFFFAOYSA-N
Molecular Formula	C11H15NO2

692

Xylenecyanol FF, Electrophoresis Reagent, dye content 70%

CAS: 2650-17-1 Molecular Formula: C25H27N2NaO6S2 Molecular Weight (g/mol): 538.61 MDL Number: MFCD00019481 InChI Key: VVLFAAMTGMGYBS-KRQUPCAFSA-M Synonym: Acid Blue 147,C.I. 42135 IUPAC Name: sodium 4-{[4-(ethylamino)-3-methylphenyl][(1Z,4Z)-4-(ethylimino)-3-methylcyclohexa-2,5-dien-1-ylidene]methyl}-3-sulfobenzene-1-sulfonate SMILES: [Na+].CCNC1=C(C)C=C(C=C1)C(=C1/C=C\C(=N\CC)\C(C)=C1)\C1=C(C=C(C=C1)S([O-])(=O)=O)S(O)(=O)=O

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Specifications

CAS	2650-17-1
Molecular Weight (g/mol)	538.61
MDL Number	MFCD00019481
SMILES	[Na+].CCNC1=C(C)C=C(C=C1)C(=C1/C=C\C(=N\CC)\C(C)=C1)\C1=C(C=C(C=C1)S([O-])(=O)=O)S(O)(=O)=O
Synonym	Acid Blue 147,C.I. 42135
IUPAC Name	sodium 4-{[4-(ethylamino)-3-methylphenyl][(1Z,4Z)-4-(ethylimino)-3-methylcyclohexa-2,5-dien-1-ylidene]methyl}-3-sulfobenzene-1-sulfonate
InChI Key	VVLFAAMTGMGYBS-KRQUPCAFSA-M
Molecular Formula	C25H27N2NaO6S2

693

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Ethyl 2-amino-3,3,3-trifluoropropionate hydrochloride, 96%, Thermo Scientific Chemicals

CAS: 193140-71-5 Molecular Formula: C5H9ClF3NO2 Molecular Weight (g/mol): 207.58 MDL Number: MFCD14525479 InChI Key: MNFISCBCWBUTTQ-UHFFFAOYNA-N Synonym: ethyl 2-amino-3,3,3-trifluoropropanoate hydrochloride,2-amino-3,3,3-trifluoro-propionic acid ethyl ester hydrochloride,ethyl 3,3,3-trifluoroalaninate,ethyl 2-amino-3,3,3-trifluoropropionate hydrochloride,ethyl 3,3,3-trifluoroalaninate-hydrogen chloride 1/1 PubChem CID: 45790935 SMILES: Cl.CCOC(=O)C(N)C(F)(F)F

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Specifications

PubChem CID	45790935
CAS	193140-71-5
Molecular Weight (g/mol)	207.58
MDL Number	MFCD14525479
SMILES	Cl.CCOC(=O)C(N)C(F)(F)F
Synonym	ethyl 2-amino-3,3,3-trifluoropropanoate hydrochloride,2-amino-3,3,3-trifluoro-propionic acid ethyl ester hydrochloride,ethyl 3,3,3-trifluoroalaninate,ethyl 2-amino-3,3,3-trifluoropropionate hydrochloride,ethyl 3,3,3-trifluoroalaninate-hydrogen chloride 1/1
InChI Key	MNFISCBCWBUTTQ-UHFFFAOYNA-N
Molecular Formula	C5H9ClF3NO2

694

TraceCERT™ Pyrimethanil, Certified Reference Material, MilliporeSigma™ Supelco™

This certified reference material (CRM) is produced and certified in accordance with ISO/IEC 17025 and ISO 17034. This CRM is traceable to the SI through a primary reference material from a NMI. Certified content incl. uncertainty and expiry date are stated on the enclosed certificate.

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695

Methyl 1-benzyl-4-oxo-3-piperidine-carboxylate hydrochloride, 97%, Thermo Scientific™

CAS: 3939-01-3 Molecular Formula: C₁₄H₁₇NO₃·HCl Molecular Weight (g/mol): 283.76 MDL Number: MFCD00012799 InChI Key: BRADBAOVPACOQQ-UHFFFAOYNA-N Synonym: methyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride,methyl 1-benzyl-4-oxo-3-piperidinecarboxylate hydrochloride,methyl 1-benzyl-4-oxo-3-piperidine-carboxylate hydrochloride,1-benzyl-3-carbomethoxy-4-piperidone hydrochloride,1-benzyl-3-methoxycarbonyl-4-piperidone hydrochloride,methyl 1-benzyl-4-oxo-3-piperidinecarboxylate, hcl,methyl 1-benzyl-4-oxopiperidine-3-carboxylate hcl,1-benzyl-3-methoxycarbonyl-4-piperidone hcl,pubchem12956,acmc-1cll5 PubChem CID: 107479

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Specifications

PubChem CID	107479
CAS	3939-01-3
Molecular Weight (g/mol)	283.76
MDL Number	MFCD00012799
Synonym	methyl 1-benzyl-4-oxopiperidine-3-carboxylate hydrochloride,methyl 1-benzyl-4-oxo-3-piperidinecarboxylate hydrochloride,methyl 1-benzyl-4-oxo-3-piperidine-carboxylate hydrochloride,1-benzyl-3-carbomethoxy-4-piperidone hydrochloride,1-benzyl-3-methoxycarbonyl-4-piperidone hydrochloride,methyl 1-benzyl-4-oxo-3-piperidinecarboxylate, hcl,methyl 1-benzyl-4-oxopiperidine-3-carboxylate hcl,1-benzyl-3-methoxycarbonyl-4-piperidone hcl,pubchem12956,acmc-1cll5
InChI Key	BRADBAOVPACOQQ-UHFFFAOYNA-N
Molecular Formula	C₁₄H₁₇NO₃·HCl

696

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2-Carbamoyl-3-fluorobenzeneboronic acid pinacol ester, 96%

Synonym: 2-Carbamoyl-3-fluorophenylboronic acid pinacol ester

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Specifications

Synonym	2-Carbamoyl-3-fluorophenylboronic acid pinacol ester

697

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Ethylenediaminetetraacetic acid tetrasodium salt hydrate, 98%

CAS: 194491-31-1 Molecular Formula: C10H12N2Na4O8 Molecular Weight (g/mol): 380.17 MDL Number: MFCD00150025 InChI Key: UEUXEKPTXMALOB-UHFFFAOYSA-J Synonym: edta tetrasodium salt,ethylenediaminetetraacetic acid tetrasodium salt hydrate,tetrasodium 2-2-bis carboxylatomethyl amino ethyl carboxylatomethyl amino acetate hydrate,tetrasodium ion 4-edta hydrate,ethylenediaminetetraacetic acid, tetrasodium salt hydrate,ethylenediaminetetraacetic acid tetrasodium salt hydrate kt,ethylenediaminetetraacetic acid tetrasodium salt hydrate, bioultra kt,ethylenediaminetetraacetic acid tetrasodium salt hydrate, practical grade PubChem CID: 16211056 IUPAC Name: tetrasodium;2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate;hydrate SMILES: [Na+].[Na+].[Na+].[Na+].[O-]C(=O)CN(CCN(CC([O-])=O)CC([O-])=O)CC([O-])=O

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Specifications

PubChem CID	16211056
CAS	194491-31-1
Molecular Weight (g/mol)	380.17
MDL Number	MFCD00150025
SMILES	[Na+].[Na+].[Na+].[Na+].[O-]C(=O)CN(CCN(CC([O-])=O)CC([O-])=O)CC([O-])=O
Synonym	edta tetrasodium salt,ethylenediaminetetraacetic acid tetrasodium salt hydrate,tetrasodium 2-2-bis carboxylatomethyl amino ethyl carboxylatomethyl amino acetate hydrate,tetrasodium ion 4-edta hydrate,ethylenediaminetetraacetic acid, tetrasodium salt hydrate,ethylenediaminetetraacetic acid tetrasodium salt hydrate kt,ethylenediaminetetraacetic acid tetrasodium salt hydrate, bioultra kt,ethylenediaminetetraacetic acid tetrasodium salt hydrate, practical grade
IUPAC Name	tetrasodium;2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate;hydrate
InChI Key	UEUXEKPTXMALOB-UHFFFAOYSA-J
Molecular Formula	C10H12N2Na4O8

698

Hydroflumethiazide, British Pharmacopoeia (BP) Reference Standard, MilliporeSigma™ Supelco™

This product is provided as delivered and specified by the issuing Pharmacopoeia. All information provided in support of this product, including SDS and any product information leaflets, has been developed and issued under the Authority of the issuing Pharmacopoeia.

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699

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tert-Butyl (S)-5-oxopyrrolidine-2-carboxylate, 95%

CAS: 35418-16-7 Molecular Formula: C9H15NO3 Molecular Weight (g/mol): 185.223 MDL Number: MFCD06659481 InChI Key: QXGSPAGZWRTTOT-LURJTMIESA-N Synonym: s-tert-butyl 5-oxopyrrolidine-2-carboxylate,s-2-pyrrolidone-5-carboxylic acid t-butyl ester,tert-butyl 5-oxo-l-prolinate,l-pyroglutamic acid tert-butyl ester,tert-butyl s-2-pyrrolidone-5-carboxylate,tert-butyl l-pyroglutamate,tert-butyl 2s-5-oxopyrrolidine-2-carboxylate,s-5-oxo-pyrrolidine-2-carboxylic acid tert-butyl ester,l-pyroglutamicacidtert-butylester,tert-butyl s-5-oxopyrrolidine-2-carboxylate PubChem CID: 10888648 IUPAC Name: tert-butyl (2S)-5-oxopyrrolidine-2-carboxylate SMILES: CC(C)(C)OC(=O)C1CCC(=O)N1

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Specifications

PubChem CID	10888648
CAS	35418-16-7
Molecular Weight (g/mol)	185.223
MDL Number	MFCD06659481
SMILES	CC(C)(C)OC(=O)C1CCC(=O)N1
Synonym	s-tert-butyl 5-oxopyrrolidine-2-carboxylate,s-2-pyrrolidone-5-carboxylic acid t-butyl ester,tert-butyl 5-oxo-l-prolinate,l-pyroglutamic acid tert-butyl ester,tert-butyl s-2-pyrrolidone-5-carboxylate,tert-butyl l-pyroglutamate,tert-butyl 2s-5-oxopyrrolidine-2-carboxylate,s-5-oxo-pyrrolidine-2-carboxylic acid tert-butyl ester,l-pyroglutamicacidtert-butylester,tert-butyl s-5-oxopyrrolidine-2-carboxylate
IUPAC Name	tert-butyl (2S)-5-oxopyrrolidine-2-carboxylate
InChI Key	QXGSPAGZWRTTOT-LURJTMIESA-N
Molecular Formula	C9H15NO3

700

D(-)-Glutamic acid, 99+%

CAS: 6893-26-1 Molecular Weight (g/mol): 147.13 MDL Number: MFCD00063112 InChI Key: WHUUTDBJXJRKMK-GSVOUGTGSA-N Synonym: d-glutamic acid,h-d-glu-oh,d-glu,r-2-aminopentanedioic acid,2r-2-aminopentanedioic acid,d-glutamate,d-2-aminopentanedioic acid,glutamic acid d-form,d--glutamic acid,d-glutaminic acid PubChem CID: 23327 ChEBI: CHEBI:15966 IUPAC Name: (2R)-2-aminopentanedioic acid SMILES: C(CC(=O)O)C(C(=O)O)N

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Specifications

PubChem CID	23327
CAS	6893-26-1
Molecular Weight (g/mol)	147.13
ChEBI	CHEBI:15966
MDL Number	MFCD00063112
SMILES	C(CC(=O)O)C(C(=O)O)N
Synonym	d-glutamic acid,h-d-glu-oh,d-glu,r-2-aminopentanedioic acid,2r-2-aminopentanedioic acid,d-glutamate,d-2-aminopentanedioic acid,glutamic acid d-form,d--glutamic acid,d-glutaminic acid
IUPAC Name	(2R)-2-aminopentanedioic acid
InChI Key	WHUUTDBJXJRKMK-GSVOUGTGSA-N

701

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5alpha-Cholestan-3-one, 97%

CAS: 566-88-1 Molecular Formula: C27H46O Molecular Weight (g/mol): 386.664 MDL Number: MFCD00065901 InChI Key: PESKGJQREUXSRR-UXIWKSIVSA-N Synonym: 5alpha-cholestan-3-one,5a-cholestan-3-one,5alpha-cholestanone,coprostanone,5alpha-cholestane-3-one,cholestan-3-one, 5a,3-keto-5alpha-cholestane,5-alpha-cholestan-3-one,cholestan-3-one PubChem CID: 92128 ChEBI: CHEBI:17762 IUPAC Name: (5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one SMILES: CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(=O)C4)C)C

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Specifications

PubChem CID	92128
CAS	566-88-1
Molecular Weight (g/mol)	386.664
ChEBI	CHEBI:17762
MDL Number	MFCD00065901
SMILES	CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(=O)C4)C)C
Synonym	5alpha-cholestan-3-one,5a-cholestan-3-one,5alpha-cholestanone,coprostanone,5alpha-cholestane-3-one,cholestan-3-one, 5a,3-keto-5alpha-cholestane,5-alpha-cholestan-3-one,cholestan-3-one
IUPAC Name	(5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
InChI Key	PESKGJQREUXSRR-UXIWKSIVSA-N
Molecular Formula	C27H46O

702

Magnesium sulfamate hydrate, 99%

CAS: 13770-91-7 Molecular Formula: H4MgN2O6S2 MDL Number: MFCD00210632 InChI Key: YZVJHCGMTYDKFR-UHFFFAOYSA-L Synonym: magnesium disulfamate,magnesium sulfamate,magnesium disulphamate,sulfamic acid, magnesium salt 2:1,magnesium 2+ ion disulfamate PubChem CID: 166902 IUPAC Name: magnesium;disulfamate

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Specifications

PubChem CID	166902
CAS	13770-91-7
MDL Number	MFCD00210632
Synonym	magnesium disulfamate,magnesium sulfamate,magnesium disulphamate,sulfamic acid, magnesium salt 2:1,magnesium 2+ ion disulfamate
IUPAC Name	magnesium;disulfamate
InChI Key	YZVJHCGMTYDKFR-UHFFFAOYSA-L
Molecular Formula	H4MgN2O6S2

703

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2-Cyclohexen-1-one, 97%

CAS: 930-68-7 Molecular Formula: C6H8O Molecular Weight (g/mol): 96.13 MDL Number: MFCD00001577 InChI Key: FWFSEYBSWVRWGL-UHFFFAOYSA-N Synonym: 2-cyclohexen-1-one,cyclohex-2-enone,2-cyclohexenone,cyclohexenone,3-oxocyclohexene,1-cyclohexen-3-one,cyclohexen-3-one,cyclohexen-1-one,2-cyclohexenone-1,2-cyclohexene-1-one PubChem CID: 13594 ChEBI: CHEBI:15977 IUPAC Name: cyclohex-2-en-1-one SMILES: O=C1CCCC=C1

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Specifications

PubChem CID	13594
CAS	930-68-7
Molecular Weight (g/mol)	96.13
ChEBI	CHEBI:15977
MDL Number	MFCD00001577
SMILES	O=C1CCCC=C1
Synonym	2-cyclohexen-1-one,cyclohex-2-enone,2-cyclohexenone,cyclohexenone,3-oxocyclohexene,1-cyclohexen-3-one,cyclohexen-3-one,cyclohexen-1-one,2-cyclohexenone-1,2-cyclohexene-1-one
IUPAC Name	cyclohex-2-en-1-one
InChI Key	FWFSEYBSWVRWGL-UHFFFAOYSA-N
Molecular Formula	C6H8O

704

Butyl Acetate, 99.5%, MilliporeSigma™

CAS: 123-86-4 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 InChI Key: DKPFZGUDAPQIHT-UHFFFAOYSA-N IUPAC Name: butyl acetate SMILES: CCCCOC(C)=O

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Specifications

CAS	123-86-4
Molecular Weight (g/mol)	116.16
SMILES	CCCCOC(C)=O
IUPAC Name	butyl acetate
InChI Key	DKPFZGUDAPQIHT-UHFFFAOYSA-N
Molecular Formula	C6H12O2

705

Ferrocenoyl chloride, For HPLC derivatization, ≥96.0% (AT), MilliporeSigma™ Supelco™

Synonym: 1-Chlorocarbonylferrocene

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Specifications

Synonym	1-Chlorocarbonylferrocene

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