AG0005XG

10191-24-9 | Hexanoic acid, 3-hydroxy-

AG0005XG

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CAS Number	10191-24-9
Catalog Number	AG0005XG(AGN-PC-00H0Q1)
Chemical Name	Hexanoic acid, 3-hydroxy-
IUPAC Name	3-hydroxyhexanoic acid
InChI	InChI=1S/C6H12O3/c1-2-3-5(7)4-6(8)9/h5,7H,2-4H2,1H3,(H,8,9)
InChI Key	HPMGFDVTYHWBAG-UHFFFAOYSA-N
MDL Number	MFCD02259045
Molecular Formula	C6H12O3
Molecular Weight	132.1577
SMILES	CCCC(O)CC(O)=O
Synonyms	3-hydroxycaproic acid, 3-hydroxyhexanoate, 3-hydroxyhexanoic acid, 3-Hydroxyhexanoic acid, 10191-24-9, 3-Hydroxycaproic acid, Hexanoic acid, 3-hydroxy-, 3-hydroxy-hexanoic acid, Hexanoic acid,3-hydroxy-, DL-3-hydroxy caproic acid, 3-hydroxy hexanoic acid, SCHEMBL20843, racemic 3-hydroxyhexanoic acid, AC1L46G0, (+/-)-3-Hydroxyhexanoic Acid, CHEBI:37035, CTK4A0394, HPMGFDVTYHWBAG-UHFFFAOYSA-N, LMFA01050012, MFCD02259045, AKOS011682999, MCULE-3158579605, NE57377, 6:0(3-OH), FT-0669373, EN300-79913, J-000518, Z1259339754, |A-Hydroxycaproic Acid, |A-Hydroxyhexanoic Acid, Hexanoicacid,3-hydroxy-, UNII-48NUX22XXO, |A-Hydroxy-n-caproic Acid, 48NUX22XXO, FA(6:0(OH)), C6-H12-O3, CID151492,

Complexity	90.3
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	132.079g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	132.159g/mol
Monoisotopic Mass	132.079g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	57.5A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number