AG003JKE

300-85-6 | 3-Hydroxybutanoic acid

AG003JKE

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CAS Number	300-85-6
Catalog Number	AG003JKE(AGN-PC-00UNUQ)
Chemical Name	3-Hydroxybutanoic acid
IUPAC Name	3-hydroxybutanoic acid
InChI	InChI=1S/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)
InChI Key	WHBMMWSBFZVSSR-UHFFFAOYSA-N
MDL Number	MFCD00004546
Molecular Formula	C4H8O3
Molecular Weight	104.1045
NSC Number	3806
SMILES	CC(O)CC(O)=O
Synonyms	(+ -)-3-Hydroxybutyric Acid, 3 Hydroxybutyrate, 3 Hydroxybutyric Acid, 3-Hydroxybutyrate, 3-Hydroxybutyric Acid, beta Hydroxybutyrate, beta Hydroxybutyric Acid, beta-Hydroxybutyrate, beta-Hydroxybutyric Acid, 3-hydroxybutyric acid, 3-hydroxybutanoic acid, 300-85-6, Butanoic acid, 3-hydroxy-, beta-Hydroxybutyric acid, DL-beta-Hydroxybutyric acid, beta-Hydroxybuttersaeure, 3 HBA, 3-Hydroxybuttersaeure, beta-Hydroxy-n-butyric acid, 625-71-8, DL-3-Hydroxybutyric Acid, Butyric acid, 3-hydroxy-, 3-hydroxy-butanoic acid, beta-hydroxybutanoic acid, (1)-3-Hydroxybutyric acid, Poly-beta-hydroxybutyric acid, (+-)-3-Hydroxybutyric acid, 3-OH-butyric acid, 3-hydroxy-butyric acid, NSC 3806, Butanoic acid,3-hydroxy-, .beta.-Hydroxybutyric acid, DL-3-Hydroxy-n-butyric Acid, .beta.-Hydroxy-n-butyric acid, AI3-21675, D(-)-beta-hydroxy butyric acid, CHEBI:20067, WHBMMWSBFZVSSR-UHFFFAOYSA-N, Butyric acid, 3-hydroxy- (8CI), MFCD00004546, DL-3-Hydroxybutyrate, 3-Hydroxybutyric acid, 98%, 3 Hydroxybutyrate, SMR000112209, b-Hydroxybutyric acid, Poly(3-hydroxybutyrate), Poly-beta-hydroxybutyrate, b-Hydroxybutyrate, b-Hydroxybutanoate, 3-Hydroxybutanoic acid homopolymer, 3-hydroxy-butanoate, EINECS 206-099-9, EINECS 210-908-0, BHBA, b-Hydroxy-n-butyrate, b-Hydroxybutanoic acid, 3- hydroxybutyric acid, 3-oxidanylbutanoic acid, PubChem13860, DL-b-Hydroxybutyric acid, b-Hydroxy-n-butyric acid, ACMC-1AY9Q, bmse000161, bmse000905, SCHEMBL2731, MLS001332397, MLS001332398, 3-Hydroxybutyric acid, 95%, DL-.beta.-Hydroxybutyric acid, AC1L198P, CHEMBL1162496, CTK4G4394, NSC3806, (.+/-.)-3-Hydroxybutyric acid, HMS2270C20, HMS3369F13, NSC-3806, BBL027467, LMFA01050005, SBB065815, STL377875, AKOS009156821, AC-5701, MCULE-3566732882, RTR-012974, Butanoic acid, 3-hydroxy-, homopolymer, 26063-00-3, AK-89074, AK116228, AN-10697, AN-23366, M347, HY-113378, TL8004190, 4CH-014288, CS-0062335, FT-0615836, FT-0625402, A833855, I04-0448, I04-9929, J-016241, J-017776, 869DD3C9-3114-4BE2-B4A6-6F1787476E95, Biopol, 3-hydroxybutyrate, 3-hydroxybutanoate, beta-hydroxybutyrate, 3-hydroxy-butyrate, (S)-3-hydroxybutanoic acid, beta Hydroxybutyrate, beta-hydroxybutanoate, 3 Hydroxybutyric Acid, (R)-3-Hydroxybutanoic acid, beta-hydroxy-n-butyrate, beta Hydroxybutyric Acid, (R)-3-Hydroxybutyric acid, 3-HYDROXYBUTYRICACID, (S)-3-Hydroxybutyric acid, C4H8O3, UNII-TZP1275679, (3R)-3-hydroxybutanoic acid, (3S)-3-hydroxybutanoic acid, CID441, (+ -)-3-Hydroxybutyric Acid, Butyric acid, 3-hydroxy-, DL-, (C4-H8-O3)x-, C4-H8-O3, FA(4:0(OH)), 3-Hydroxybutyric acid, technical 5g, TZP1275679, Butanoic acid, 3-hydroxy-, (.+.)-, Butanoic acid, 3-hydroxy-, (.+-.)-, H0228, 6168-83-8, 625-72-9, D020155,

Complexity	69.3
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	104.047g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	104.105g/mol
Monoisotopic Mass	104.047g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	57.5A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	-0.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H315-H319-H335
Packing Group	Ⅱ
Precautionary statements	P261-P305+P351+P338
Signal Words	warning
UN Code	UN 3265

Certificate of Analysis

Lot Number