1- (3-chlorophenyl) cyclobutanol

CAT: 0127-OR1084202-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1084202-01Size:250 mg

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

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CAS Number

1511478-54-8

MDL Number

MFCD21788637

Purity

97%

Smiles

OC1 (c2cc (Cl) ccc2) CCC1

Chemical Information

1-(3-Chlorophenyl)cyclobutanol

CAS Number	1511478-54-8
PubChem CID	79081303
IUPAC Name	1-(3-chlorophenyl)cyclobutan-1-ol
Molecular Formula	C10H11ClO
Molecular Weight	182.64
XLogP	2.4
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	12
Formal Charge	0
Complexity	165

SMILES

C1CC(C1)(C2=CC(=CC=C2)Cl)O

InChI

InChI=1S/C10H11ClO/c11-9-4-1-3-8(7-9)10(12)5-2-6-10/h1,3-4,7,12H,2,5-6H2

InChIKey

MJPYTNUCFDHYJS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1511478-54-8

CID: 79081303

Formula: C10H11ClO

MW: 182.64

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	182.64
XLogP3	2.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	182.0498427
Monoisotopic Mass	182.0498427
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	165
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
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OR1085012-01	1- (3-cyclobutylphenyl) cyclobutanol
OR1084391-01	1- (3-ethoxyphenyl) cyclobutanol
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OR1086831-01	1- (3-isopropylphenyl) cyclobutanol
PC1021427-01	1- (3-fluorophenyl) cyclobutanol

Catalog	Name
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