4-Methyloct-7-en-2-ol

CAT: 0926-SDC50998-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-SDC50998-01Size:50 mg

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CAS Number

1342509-98-1

MDL Number

MFCD20399785

Smiles

CC (CCC=C) CC (C) O

Molecular Formula

C9H18O

Molecular Weight

142.24 g/mol

Controlled

Chemical Information

4-Methyloct-7-en-2-ol

CAS Number	1342509-98-1
PubChem CID	64719227
IUPAC Name	4-methyloct-7-en-2-ol
Molecular Formula	C9H18O
Molecular Weight	142.24
XLogP	2.8
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	5
Heavy Atom Count	10
Formal Charge	0
Complexity	88

SMILES

CC(CCC=C)CC(C)O

InChI

InChI=1S/C9H18O/c1-4-5-6-8(2)7-9(3)10/h4,8-10H,1,5-7H2,2-3H3

InChIKey

QGJZYOPWYGEGFR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1342509-98-1

CID: 64719227

Formula: C9H18O

MW: 142.24

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	142.24
XLogP3	2.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	5
Exact Mass	142.135765193
Monoisotopic Mass	142.135765193
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	88.7
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
DAA66461-01	3-Methyloct-7-en-2-one
VMA59044-01	2-Cyclohexylpent-4-en-2-ol
BS160361-01	Stigmast-7-en-3-ol
RAA01471-01	2-Phenylpent-4-en-1-ol
EMA02067-01	2-Aminopent-4-en-1-ol
LCA07765-01	1-Phenylpent-4-en-2-ol
GDA33605-01	2- (4-Bromophenyl) pent-4-en-2-ol
KCA57361-01	2- (4-Methoxyphenyl) pent-4-en-2-ol
FFC00574-01	2-Aminopent-4-en-1-ol hydrochloride
BAA77539	(2E) -4-Chlorobut-2-en-1-ol

Catalog	Name
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OR1066239-01	2-Methyl-6-methyleneoct-7-en-4-ol
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OR1029572-01	2-Phenylpent-4-En-2-Ol
434219-01	4α-Carboxy-cholest-7-en-3β-ol
MBS5790988	Stigmast-7-en-3-ol
HY-N9304	Fern-7-en-19α-ol
OR1022320-01	Oct-7-en-1-ol
OR1053800-01	2-Methylpent-4-en-1-ol