α-Ethenyl-3-ethylbenzenemethanol

CAT: 0127-OR1087822-01Size: 250 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0127-OR1087822-01Size:250 mg

Selected

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

Quick Request Actions

CAS Number

2228776-42-7

MDL Number

MFCD34870202

Purity

97%

Smiles

C (C=C) (O) c1cc (CC) ccc1

Chemical Information

1-(3-Ethylphenyl)prop-2-en-1-ol

CAS Number	2228776-42-7
PubChem CID	165612920
IUPAC Name	1-(3-ethylphenyl)prop-2-en-1-ol
Molecular Formula	C11H14O
Molecular Weight	162.23
XLogP	2.7
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	142

SMILES

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

InChI

InChI=1S/C11H14O/c1-3-9-6-5-7-10(8-9)11(12)4-2/h4-8,11-12H,2-3H2,1H3

InChIKey

JPWLNGMVGSSMKH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2228776-42-7

CID: 165612920

Formula: C11H14O

MW: 162.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	162.23
XLogP3	2.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Exact Mass	162.104465066
Monoisotopic Mass	162.104465066
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	142
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

Catalog	Name
OR1080312-01	α-Ethenyl-2-ethylbenzenemethanol
OR1082865-01	α-Ethenyl-4-ethylbenzenemethanol
OR1094877	3-Ethoxy-α-ethylbenzenemethanol
OR1084838-01	3-Cyclobutyl-α-ethylbenzenemethanol
OR1084126-01	α-Cyclopentyl-3-ethylbenzenemethanol
OR1086388-01	α-Cyclopropyl-3-ethylbenzenemethanol
OR1099898-01	2,3-Dichloro-α-ethylbenzenemethanol
OR1098270	3,4-Dichloro-α-ethylbenzenemethanol
OR1084187-01	3-Chloro-4-ethoxy-α-ethylbenzenemethanol
OR1082322-01	3- (1,1-Dimethylethyl) -α-ethylbenzenemethanol

Catalog	Name
275061-01	3-Ethenyl nevirapine
425423-01	3-Ethenyl-morpholine
FHC09204-01	2-Ethenyl-3-fluoropyridine
DEA26281-01	1-Ethenyl-3-methanesulfonylbenzene
JH468998	1-ethenyl-3-ethylbenzene
JH915080	3-ETHENYL-5-FLUOROPYRIDINE
YIB95115-01	3-Ethenyl-5-methoxypyridine
NAA81602-01	2-Ethenyl-1,3-thiazole
275427-01	2-Ethenyl-3,5-dimethylpyrazine
JH330514	1-ethenyl-3,5-dimethylbenzene