AG0032H2

62214-39-5 | (S)-But-3-ene-1,2-diol

AG0032H2

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CAS Number	62214-39-5
Catalog Number	AG0032H2(AGN-PC-0WCR8G)
Chemical Name	(S)-But-3-ene-1,2-diol
IUPAC Name	(2S)-but-3-ene-1,2-diol
InChI	InChI=1S/C4H8O2/c1-2-4(6)3-5/h2,4-6H,1,3H2/t4-/m0/s1
InChI Key	ITMIAZBRRZANGB-BYPYZUCNSA-N
MDL Number	MFCD00145261
Molecular Formula	C4H8O2
Molecular Weight	88.1051
SMILES	C([C@H](C=C)O)O
UNII	N4142M4L8H
Synonyms	(S)-But-3-ene-1,2-diol, (S)-3-Butene-1,2-diol, 62214-39-5, (2s)-3-butene-1,2-diol, UNII-N4142M4L8H, (2S)-but-3-ene-1,2-diol, N4142M4L8H, PubChem19971, AC1OE5SJ, CTK8C6268, 3-Butene-1,2-diol, (S)-, 3-Butene-1,2-diol,(2S)-, 3-Butene-1,2-diol, (2S)-, ACT02749, ZINC2040446, FCH3462130, CJ-07617, CJ-32383, AB0075500, AX8266740, DB-016882, TC-172614, FT-0690355, A23734, X-3360, (S)-3-Butene-1,2-diol >=97.0% (GC), (S)-3-Butene-1,2-diol, >=97.0% (GC), 214B395, S14-2266, UNII-PP8001HM3T component ITMIAZBRRZANGB-BYPYZUCNSA-N, Erythrol, but-3-ene-1,2-diol, 3,4-Dihydroxy-1-butene, 3-BUTENE-1,2-DIOL, CB11297, CID6999958, 497-06-3,

Complexity	42.8
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
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	2
Isotope Atom Count	0
Molecular Weight	88.106g/mol
Monoisotopic Mass	88.052g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	40.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.5

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

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