AG00341V

590-90-9 | 4-Hydroxy-2-butanone

AG00341V

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CAS Number	590-90-9
Catalog Number	AG00341V(AGN-PC-0JLHYG)
Chemical Name	4-Hydroxy-2-butanone
EC Number	209-693-6
IUPAC Name	4-hydroxybutan-2-one
InChI	InChI=1S/C4H8O2/c1-4(6)2-3-5/h5H,2-3H2,1H3
InChI Key	LVSQXDHWDCMMRJ-UHFFFAOYSA-N
MDL Number	MFCD00059005
Molecular Formula	C4H8O2
Molecular Weight	88.1051
NSC Number	41219
SMILES	O=C(C)CCO
UNII	TCM0BJ44MF
Synonyms	4-hydroxy-2-butanone, 4H2B compound, 4-Hydroxy-2-butanone, 4-Hydroxybutan-2-one, 590-90-9, 2-Butanone, 4-hydroxy-, Methylolacetone, 3-Oxo-1-butanol, 3-Oxobutanol, 3-Ketobutan-1-ol, Monomethylolacetone, 4-Butanol-2-one, UNII-TCM0BJ44MF, 2-Hydroxyethyl methyl ketone, NSC 41219, TCM0BJ44MF, CH3C(O)CH2CH2OH, LVSQXDHWDCMMRJ-UHFFFAOYSA-N, MFCD00059005, BUQ, Ketones, C4-6, beta-hydroxy, 3-ketobutanol, 4-hydroxy butanone, EINECS 209-693-6, 1-hydroxy-3-butanone, 4-oxidanylbutan-2-one, 1d7j, 1 -hydroxy-3-butanone, 4-hydroxy-butan-2-one, AI3-11747, EC 209-693-6, ACMC-1B12A, ghl.PD_Mitscher_leg0.412, 68648-26-0, KSC269Q7R, methyl beta-hydroxyethyl ketone, 4-Hydroxy-2-butanone, 95%, AC1L39Q7, AC1Q1K65, DTXSID4060442, CHEBI:41268, CTK1G9878, KS-00000W4D, NSC41219, ZINC1672523, ANW-33145, BBL028076, NSC-41219, STL372661, AKOS009156643, DB04094, MCULE-6328537335, NE11096, QC-9043, RTR-020505, TRA0096514, AN-46185, CJ-06135, SC-65678, SY002849, TR-020505, FT-0618625, V1967, MFCD00059005 (95+%), A832151, I14-4515, Z1939437504, InChI=1/C4H8O2/c1-4(6)2-3-5/h5H,2-3H2,1H, D04NBE, C4H8O2, Ketones, C4-6, .beta.-hydroxy, C4-H8-O2, CID111509, ACN-032422, H0584, 4-Hydroxy-2-butanone, 95% - 100G 100g,

Complexity	49.5
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	88.052g/mol
Formal Charge	0
Heavy Atom Count	6
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	88.106g/mol
Monoisotopic Mass	88.052g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H226
Packing Group	Ⅲ
Precautionary statements	P210-P403+P235
UN Code	UN 1993

Certificate of Analysis

Lot Number