AG001ZC1

17397-24-9 | (S)-(+)-5-Hexen-2-ol

AG001ZC1

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CAS Number	17397-24-9
Catalog Number	AG001ZC1(AGN-PC-0O4X9Y)
Chemical Name	(S)-(+)-5-Hexen-2-ol
IUPAC Name	(2S)-hex-5-en-2-ol
InChI	InChI=1S/C6H12O/c1-3-4-5-6(2)7/h3,6-7H,1,4-5H2,2H3/t6-/m0/s1
InChI Key	LNPNXWKVAFKIBX-LURJTMIESA-N
MDL Number	MFCD03701537
Molecular Formula	C6H12O
Molecular Weight	100.1589
SMILES	C[C@@H](CCC=C)O
Synonyms	(S)-(+)-5-Hexen-2-ol, 17397-24-9, (S)-(+)-2-HYDROXYHEX-5-ENE, (s)-hex-5-en-2-ol, (S)-2-hydroxyhex-5-ene, 5-Hexen-2-ol,(2S)-, SCHEMBL282934, 5-Hexen-2-ol, (2S)-, CTK0H4088, [S,(+)]-5-Hexen-2-ol, (2S)-HEX-5-EN-2-OL, ZINC2003061, ZX-RL004936, AKOS017343751, FCH1122549, ACM17397249, (+)-(S)-HEX-1-EN-5-OL, AJ-32379, CJ-30917, OR304053, DB-005546, TC-172656, FT-0081327, FT-0651105, J-010955, I14-39434, (S)-(+)-5-Hexen-2-ol, 97%, optical purity99.3%, 5-HEXEN-2-OL, Methyl(2-vinylethyl)carbinol, CID11848710, 626-94-8,

Complexity	50.1
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	100.089g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	100.161g/mol
Monoisotopic Mass	100.089g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H226
Precautionary statements

Certificate of Analysis

Lot Number