1-Phenyl-2-propyn-1-ol

CAT: 0572-TRC-P336418-250MGSize: 250 mgDry Ice: NoHazardous: No

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CAT#:0572-TRC-P336418-250MGSize:250 mg

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CAS Number

4187-87-5

Hazard Statement

No Data Available

Smiles

OC(C#C)c1ccccc1

Molecular Formula

C9H8O

Molecular Weight

132.15

Shipping Conditions

Room Temperature

Chemical Information

alpha-Ethynylbenzenemethanol

CAS Number	4187-87-5
PubChem CID	20155
IUPAC Name	1-phenylprop-2-yn-1-ol
Molecular Formula	C9H8O
Molecular Weight	132.16
XLogP	1.3
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	10
Formal Charge	0
Complexity	136

SMILES

C#CC(C1=CC=CC=C1)O

InChI

InChI=1S/C9H8O/c1-2-9(10)8-6-4-3-5-7-8/h1,3-7,9-10H

InChIKey

UIGLAZDLBZDVBL-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 4187-87-5

CID: 20155

Formula: C9H8O

MW: 132.16

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	132.16
XLogP3	1.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	132.057514874
Monoisotopic Mass	132.057514874
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	136
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
TRC-P835786-1G	2-Propyn-1,1,3-d3-1-ol
TRC-P336405-1G	a-Phenyl-a-(2-propyn-1-yloxy)benzeneacetic Acid
TRC-T437650-100MG	1-[3-(Trifluoromethyl)phenyl]propan-2-ol
TRC-A723345-250MG	2-Amino-1-[3-(benzyloxy)phenyl]propan-1-ol
TRC-N756768-1G	1-[4-(Propan-2-yl)phenyl]ethan-1-ol
TRC-P336405-250MG	Alpha-Phenyl-Alpha-(2-propyn-1-yloxy)benzeneacetic Acid
TRC-P336405-100MG	Alpha-Phenyl-Alpha-(2-propyn-1-yloxy)benzeneacetic Acid
TRC-A636690-500MG	2-[4-(Aminomethyl)phenyl]propan-2-ol
TRC-T390710-1G	1,1,1-Trifluoro-2-phenyl-3-butyn-2-ol
TRC-A603765-2.5G	(S)-1-(2-Amino-5-chlorophenyl)-1-(trifluoromethyl)-3-cyclopropyl-2-propyn-1-ol

Catalog	Name
sc-255863	1-Phenyl-2-propyn-1-ol
PCA59956-01	(S) -1-Phenyl-2-propyn-1-ol
sc-231910	3-Phenyl-2-propyn-1-ol
sc-258077	(R) -1-Phenyl-2-propyn-1-ol
sc-224794	1-Phenyl-3- (trimethylsilyl) -2-propyn-1-ol
P15295-01	3-Phenyl-2-propyn-1-ol 98%
FD30004	1,1-Diphenyl-2-propyn-1-ol
90028113	1-Phenyl-2-propyn-1-one
OR1024851-01	1,3-Diphenyl-2-Propyn-1-Ol
sc-225850	3- (1-Naphthyl) -2-propyn-1-ol