(S) - (+) -5-Hexen-2-ol

CAT: 0024-sc-229225Size: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-229225Size:1 g

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

17397-24-9

Chemical Information

(2S)-hex-5-en-2-ol

See also: 5-Hexen-2-ol (annotation moved to).

CAS Number	17397-24-9
PubChem CID	11848710
IUPAC Name	(2S)-hex-5-en-2-ol
Molecular Formula	C6H12O
Molecular Weight	100.16
XLogP	1.4
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Heavy Atom Count	7
Formal Charge	0
Complexity	50

SMILES

C[C@@H](CCC=C)O

InChI

InChI=1S/C6H12O/c1-3-4-5-6(2)7/h3,6-7H,1,4-5H2,2H3/t6-/m0/s1

InChIKey

LNPNXWKVAFKIBX-LURJTMIESA-N

Chemical Structure

2D Structure

CAS: 17397-24-9

CID: 11848710

Formula: C6H12O

MW: 100.16

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	100.16
XLogP3	1.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Exact Mass	100.088815002
Monoisotopic Mass	100.088815002
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	50.1
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes