1- (4-chlorophenyl) cyclopentanol

CAT: 0127-OR1093912-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1093912-01Size:250 mg

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

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CAS Number

78195-98-9

MDL Number

MFCD12762830

Purity

95%

Smiles

OC1 (c2ccc (Cl) cc2) CCCC1

Chemical Information

1-(4-Chlorophenyl)cyclopentanol

CAS Number	78195-98-9
PubChem CID	275619
IUPAC Name	1-(4-chlorophenyl)cyclopentan-1-ol
Molecular Formula	C11H13ClO
Molecular Weight	196.67
XLogP	2.7
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	13
Formal Charge	0
Complexity	167

SMILES

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

InChI

InChI=1S/C11H13ClO/c12-10-5-3-9(4-6-10)11(13)7-1-2-8-11/h3-6,13H,1-2,7-8H2

InChIKey

YKFVMWFACFMRBZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 78195-98-9

CID: 275619

Formula: C11H13ClO

MW: 196.67

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	196.67
XLogP3	2.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	196.0654927
Monoisotopic Mass	196.0654927
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	167
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
OR1098752-01	2- (4-Chlorophenyl) cyclopentanol
OR1083449-01	1-[2- (4-Chlorophenyl) ethynyl]cyclopentanol
OR1081514-01	1- (3-chlorophenyl) cyclopentanol
OR1080800-01	1- (2-chlorophenyl) cyclopentanol
OR1083457-01	1-[2- (3-Chlorophenyl) ethynyl]cyclopentanol
OR1095929	1- (4-Bromophenyl) cyclopentanol
PC1025133-01	1- (4-fluorophenyl) cyclopentanol
OR1082575-01	1- (4-propylphenyl) cyclopentanol
OR1081562-01	1- (4-ethylphenyl) cyclopentanol
OR1093910-01	1- (4-Methoxyphenyl) cyclopentanol

Catalog	Name
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