1- (3-Chlorophenyl) propan-1-ol

CAT: 0926-HBA01930Size: 2.5 gDry Ice: NoHazardous: No

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CAT#:0926-HBA01930Size:2.5 g

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CAS Number

32019-30-0

MDL Number

MFCD11149377

Smiles

CCC (C1=CC (=CC=C1) Cl) O

Molecular Formula

C9H11OCl

Molecular Weight

170.63 g/mol

Controlled

Chemical Information

3-Chloro-alpha-ethylbenzenemethanol

CAS Number	32019-30-0
PubChem CID	11147981
IUPAC Name	1-(3-chlorophenyl)propan-1-ol
Molecular Formula	C9H11ClO
Molecular Weight	170.63
XLogP	2.6
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	116

SMILES

CCC(C1=CC(=CC=C1)Cl)O

InChI

InChI=1S/C9H11ClO/c1-2-9(11)7-4-3-5-8(10)6-7/h3-6,9,11H,2H2,1H3

InChIKey

APYGJPRINQKIQF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 32019-30-0

CID: 11147981

Formula: C9H11ClO

MW: 170.63

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	170.63
XLogP3	2.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	170.0498427
Monoisotopic Mass	170.0498427
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	116
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
XAA99103-01	3- (3-Chlorophenyl) propan-1-ol
GAA28287-01	3- (2-Chlorophenyl) propan-1-ol
NCA48971-01	2- (3-Chlorophenyl) propan-1-ol
NAA85685	1- (4-Chlorophenyl) propan-1-ol
UCA38037-01	3-[ (4-Chlorophenyl) amino]propan-1-ol
UDC24304-01	1- (2-Chlorophenyl) -3- (methylsulfanyl) propan-1-ol
WBA05156-01	3-Amino-1- (4-chlorophenyl) propan-1-ol
AZB59962-01	1-Amino-3- (3-chlorophenyl) propan-2-ol
SKC92806-01	1- (3-Chlorophenyl) -3- (dimethylamino) propan-2-ol
AZB59965-01	1-Amino-3- (4-chlorophenyl) propan-2-ol

Catalog	Name
C993723	1-(3-Chlorophenyl)propan-1-ol
OR900159	3- (3-Chlorophenyl) propan-1-ol
TRC-C596505-1G	3-(4-Chlorophenyl)propan-1-ol
sc-275743	3- (4-Chlorophenyl) propan-1-ol
OR900157	3- (2-Chlorophenyl) propan-1-ol
OR1057103-01	1- (3-Chlorophenyl) propan-2-ol
OR1038280-01	1- (4-Chlorophenyl) propan-1-ol
OR32505-01	3-Amino-3- (3-chlorophenyl) propan-1-ol
AK ML 0281-01	3-amino-3- (4-chlorophenyl) propan-1-ol
OR1085384-01	1- (3-bromo-5-chlorophenyl) propan-1-ol