Eperisone Impurity 10

CAT: 1299-RM-E160510-02Size: 25 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-E160510-02Size:25 mg

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CAS Number

74532-88-0

Synonyms

1- (4-ethylphenyl) propan-1-ol

Molecular Formula

C11H16O

Molecular Weight

164.25

Target Alternative Name

Eperisone

Product Name Synonym

1- (4-ethylphenyl) propan-1-ol

Chemical Information

1-(4-Ethylphenyl)-1-propanol

CAS Number	74532-88-0
PubChem CID	22486906
IUPAC Name	1-(4-ethylphenyl)propan-1-ol
Molecular Formula	C11H16O
Molecular Weight	164.24
XLogP	2.8
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Heavy Atom Count	12
Formal Charge	0
Complexity	114

SMILES

CCC1=CC=C(C=C1)C(CC)O

InChI

InChI=1S/C11H16O/c1-3-9-5-7-10(8-6-9)11(12)4-2/h5-8,11-12H,3-4H2,1-2H3

InChIKey

NTTBDWAXCRRVJY-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 74532-88-0

CID: 22486906

Formula: C11H16O

MW: 164.24

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	164.24
XLogP3	2.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Exact Mass	164.120115130
Monoisotopic Mass	164.120115130
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	114
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes