1- (3,4-dichlorophenyl) cyclopentanol

CAT: 0127-OR1081504-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1081504-01Size:250 mg

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

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CAS Number

1247078-22-3

MDL Number

MFCD16786811

Purity

95%

Smiles

C1 (c (ccc (c1) C1 (CCCC1) O) Cl) Cl

Chemical Information

1-(3,4-Dichlorophenyl)cyclopentanol

CAS Number	1247078-22-3
PubChem CID	62537889
IUPAC Name	1-(3,4-dichlorophenyl)cyclopentan-1-ol
Molecular Formula	C11H12Cl2O
Molecular Weight	231.11
XLogP	3.4
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	14
Formal Charge	0
Complexity	201

SMILES

C1CCC(C1)(C2=CC(=C(C=C2)Cl)Cl)O

InChI

InChI=1S/C11H12Cl2O/c12-9-4-3-8(7-10(9)13)11(14)5-1-2-6-11/h3-4,7,14H,1-2,5-6H2

InChIKey

UWHUZGOVKBSMIZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1247078-22-3

CID: 62537889

Formula: C11H12Cl2O

MW: 231.11

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	231.11
XLogP3	3.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	230.0265204
Monoisotopic Mass	230.0265204
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	201
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR1084172-01	1- (2,4-dichlorophenyl) cyclopentanol
OR1082588-01	1- (2,3-dichlorophenyl) cyclopentanol
OR1099211-01	1- (3,5-dichlorophenyl) cyclopentanol
OR1082621-01	1- (2,5-dichlorophenyl) cyclopentanol
OR1091068-01	1- (3-bromo-2,5-dichlorophenyl) cyclopentanol
OR1081617-01	1- (3,4-dimethylphenyl) cyclopentanol
OR1082510-01	1- (3,4-dimethoxyphenyl) cyclopentanol
PC1010443-01	1- (3,4-difluorophenyl) cyclopentanol
OR1084513-01	1- (4-methylpyridin-3-yl) cyclopentanol
OR1082883-01	1- (4-chloro-3-methoxyphenyl) cyclopentanol

Catalog	Name
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