AG001HFS

141942-85-0 | Butanoic acid, 4-cyano-3-hydroxy-, ethyl ester, (3R)-

AG001HFS

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CAS Number	141942-85-0
Catalog Number	AG001HFS(AGN-PC-0O2BJE)
Chemical Name	Butanoic acid, 4-cyano-3-hydroxy-, ethyl ester, (3R)-
IUPAC Name	ethyl (3R)-4-cyano-3-hydroxybutanoate
InChI	InChI=1S/C7H11NO3/c1-2-11-7(10)5-6(9)3-4-8/h6,9H,2-3,5H2,1H3/t6-/m1/s1
InChI Key	LOQFROBMBSKWQY-ZCFIWIBFSA-N
MDL Number	MFCD00270839
Molecular Formula	C7H11NO3
Molecular Weight	157.1671
SMILES	O=C(OCC)C[C@H](O)CC#N
Synonyms	141942-85-0, Ethyl (R)-(-)-4-cyano-3-hydroxybutyate, Ethyl (R)-(-)-4-cyano-3-hydroxybutyrate, (R)-4-Cyano-3-hydroxybutyric acid ethyl ester, ethyl (3R)-4-cyano-3-hydroxybutanoate, (r)-ethyl 4-cyano-3-hydroxybutanoate, (R)-Ethyl 4-cyano-3-hydroxybutyrate, Ethyl-(R)-(+)-4-Cyano-3-Hydroxybutanoate, MFCD00270839, ethyl (r)-4-cyano-3-hydroxybutyrate, (R)-4-CYANO-3-HYDROXY-BUTYRIC ACID ETHYL ESTER, (R)-(-)-4-Cyano-3-hydroxybutyric Acid Ethyl Ester, Ethyl(R)-(-)-4-cyano-3-hydroxybutyrate, BUTANOIC ACID, 4-CYANO-3-HYDROXY-, ETHYL ESTER, (3R)-, Ethyl (R)-4-cyano-3-hydroxybutanoate, 95%, AK-50683, PubChem5748, AC1MBZVC, (R)-4-Cyano-3-hydroxy-butyricacidethylester, KSC522Q7D, SCHEMBL391523, CTK4C2871, KS-00000BHJ, DTXSID10370024, LOQFROBMBSKWQY-ZCFIWIBFSA-N, ZINC2562594, ethyl(R)-4-cyano-3-hydroxybutyrate, ANW-20661, SBB067618, AKOS015836108, AB05567, AC-6759, AM84382, AN-9729, CS-W002591, DS-1230, ethyl (r)-4-cyano-3-hydroxy-butyrate, RP22096, RTR-005386, ethyl-(r)-4-cyano-3-hydroxy butanoate, (r)-(-)-ethyl4-cyano-3-hydroxybutyrate, AJ-40787, BC206908, BR-50683, CC-01134, CJ-09614, ethyl (3R)-4-cyano-3-hydroxy-butanoate, SC-01051, (R)-4-Cyano-3-hydroxybutyricacidethylester, AB0011943, AX8003848, DB-009738, ST2412857, TL8006150, TR-005386, (S)-ETHYL 4-CYANO-3-HYDROXYBUTYRATE, A3065, ethyl (r)-(-)-4-cyano-3-hydroxy butyrate, FT-0626277, ST50824628, ETHYL (R)-4-CYANO-3-HYDROXYBUTANOATE, (R)-3-Hydroxy-4-cyanobutyric acid ethyl ester, (R)4-cyano-3-hydroxy butyric acid ethyl ester, 42C850, (R)-4-cyano-3-hydroxybutyric acid, ethyl ester, (3R)-4-Cyano-3-hydroxybutanoic Acid Ethyl Ester, (R)-(-)-ETHYL 4-CYANO-3-HYDROXYBUTYRATE, C-03671, Ethyl (R)-(-)-4-cyano-3-hydroxybutyrate, 95%, I14-4468, J-007571, J-520478, 1H1, C7H11NO3, Ethyl - -4-cyano-3-hydroxybutyate, ZINC02562594, ACN-032881, CB11421, CID2733879, CS-O-31954, C1474, EC 430-220-6, M-3070, (3R)-4-Cyano-3-hydroxybutyric Acid Ethyl Ester, Ethyl (R)-(-)-4-cyano-3-hydroxybutyrate, 98% - 1G 1g,

Complexity	170
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	157.074g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	157.169g/mol
Monoisotopic Mass	157.074g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	70.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

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