(E) -3- (3-Fluorophenyl) prop-2-en-1-ol

CAT: 0127-PC1003125-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-PC1003125-01Size:100 mg

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CAS Number

125872-67-5

MDL Number

MFCD11848634

Purity

95%

Smiles

OC/C=C/C1=CC=CC(F)=C1

Chemical Information

(2E)-3-(3-fluorophenyl)prop-2-en-1-ol

CAS Number	125872-67-5
PubChem CID	11051851
IUPAC Name	(E)-3-(3-fluorophenyl)prop-2-en-1-ol
Molecular Formula	C9H9FO
Molecular Weight	152.16
XLogP	0.4
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	134

SMILES

C1=CC(=CC(=C1)F)/C=C/CO

InChI

InChI=1S/C9H9FO/c10-9-5-1-3-8(7-9)4-2-6-11/h1-5,7,11H,6H2/b4-2+

InChIKey

VCJXSANJUHQWOX-DUXPYHPUSA-N

Chemical Structure

2D Structure

CAS: 125872-67-5

CID: 11051851

Formula: C9H9FO

MW: 152.16

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	152.16
XLogP3	0.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	152.063743068
Monoisotopic Mass	152.063743068
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	134
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
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
PC1004935-01	(E) -3- (4-Fluorophenyl) prop-2-en-1-ol
OR52458	(E) -3- (4-Chlorophenyl) prop-2-en-1-ol
OR89727-01	(E) -3- (3- (Benzyloxy) phenyl) prop-2-en-1-ol
OR1001873-01	(E) -3- (Pyridin-3-yl) prop-2-en-1-ol
PC1021054-01	1- (3,6-dibromo-2-fluorophenyl) prop-2-en-1-ol
PC1020599-01	1- (3,5-dibromo-2-fluorophenyl) prop-2-en-1-ol
PC1021089-01	1- (3,6-dichloro-2-fluorophenyl) prop-2-en-1-ol
PC520824	(E) -3-Butoxy-1- (3-fluorophenyl) prop-2-en-1-one
PC1013449-01	(E) -1- (2-fluorophenyl) but-2-en-1-ol
PC99768-01	(E) -3- (4- (Trifluoromethyl) phenyl) prop-2-en-1-ol

Catalog	Name
sc-260419A	3- (3-Fluorophenyl) prop-2-yn-1-ol
LQB30186-01	3- (4-Ethylphenyl) prop-2-en-1-ol
PDA63821-01	1- (2-Fluorophenyl) prop-2-en-1-one
sc-260448A	3- (4-Fluorophenyl) prop-2-yn-1-ol
TRC-T899705-1G	3-[3-(Trifluoromethyl)phenyl]prop-2-en-1-ol
EGA30948-01	1- (3- (Trifluoromethyl) phenyl) prop-2-en-1-ol
GBA70695-01	1- (3,4-Dimethoxyphenyl) prop-2-en-1-ol
BCA59459-01	1- (4-Fluorophenyl) prop-2-en-1-one
DMB33038-01	[ (3-Fluorophenyl) methyl] (prop-2-en-1-yl) amine
MEA10404-01	(2E) -3- (4-Fluorophenyl) prop-2-en-1-amine