Hotrienol

CAT: 1299-RG-E141765-02Size: 100 mgDry Ice: NoHazardous: No

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CAT#:1299-RG-E141765-02Size:100 mg

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

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CAS Number

20053-88-7

Synonyms

(R, E) -3,7-dimethylocta-1,5,7-trien-3-ol

Molecular Formula

C10H16O

Molecular Weight

152.24

Chemical Information

Hotrienol

3,7-Dimethyl-1,5(E),7-octatrien-3-ol is a tertiary alcohol.

CAS Number	20053-88-7
PubChem CID	40510009
IUPAC Name	(3R,5E)-3,7-dimethylocta-1,5,7-trien-3-ol
Molecular Formula	C10H16O
Molecular Weight	152.23
XLogP	2.8
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Heavy Atom Count	11
Formal Charge	0
Complexity	179

SMILES

CC(=C)/C=C/C[C@](C)(C=C)O

InChI

InChI=1S/C10H16O/c1-5-10(4,11)8-6-7-9(2)3/h5-7,11H,1-2,8H2,3-4H3/b7-6+/t10-/m0/s1

InChIKey

ZJIQIJIQBTVTDY-FGEFZZPRSA-N

Chemical Structure

2D Structure

CAS: 20053-88-7

CID: 40510009

Formula: C10H16O

MW: 152.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	152.23
XLogP3	2.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Exact Mass	152.120115130
Monoisotopic Mass	152.120115130
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	179
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
HY-N9050	Hotrienol