2- (4-Chlorophenyl) -2-methylpropanol

CAT: 0127-OR917141Size: 5 gDry Ice: NoHazardous: No

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CAT#:0127-OR917141Size:5 g

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CAS Number

80854-14-4

MDL Number

MFCD06657569

Purity

98%

Smiles

CC(C)(CO)c1ccc(Cl)cc1

Chemical Information

2-(4-Chlorophenyl)-2-methylpropanol

CAS Number	80854-14-4
PubChem CID	13034557
IUPAC Name	2-(4-chlorophenyl)-2-methylpropan-1-ol
Molecular Formula	C10H13ClO
Molecular Weight	184.66
XLogP	3
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	12
Formal Charge	0
Complexity	137

SMILES

CC(C)(CO)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C10H13ClO/c1-10(2,7-12)8-3-5-9(11)6-4-8/h3-6,12H,7H2,1-2H3

InChIKey

NJTICDHSNUXDFF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 80854-14-4

CID: 13034557

Formula: C10H13ClO

MW: 184.66

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	184.66
XLogP3	3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	184.0654927
Monoisotopic Mass	184.0654927
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	137
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
OR922148-01	2- (4-Ethoxyphenyl) -2-methylpropanol
OR1002789-01	2-[ (4-Chlorophenyl) thio]-2-methylpropanal
OR1003264-01	2- (4-Chlorophenyl) -2-methylpropanoyl chloride
OR470552	(4-Bromo-2-chlorophenyl) (4-chlorophenyl) methanone
OR85902-01	2- (4-Chlorophenyl) -2-methylpropane-1,3-diol
OR345030	2- (4-Chlorophenyl) -2',4'-dihydroxyacetophenone
OR314002	2- (4-Chlorophenyl) -2',4'-dichloroacetophenone
OR1098036	2- (4-chlorophenyl) -2-methylpropanenitrile
PC421016-01	2- (4-Chlorophenyl) -2'-fluoroacetophenone
OR1034063-01	2- (4-Chlorophenyl) -2-methylmorpholine

Catalog	Name
sc-487547	2- (4-Chlorophenyl) -2-methylpropanol
TRC-E895150-50MG	2-(4-Ethoxyphenyl)-2-methylpropanol
sc-485557	2- (4-Ethoxyphenyl) -2-methylpropanol
TRC-C613733-1G	(2-Chlorophenyl)(4-chlorophenyl)methanol
TBA17149-01	(2-Chlorophenyl) (4-chlorophenyl) methanol
IDC67658-01	(2-Chlorophenyl) (4-chlorophenyl) methanamine hydrochloride
sc-305104A	2- (3-Chlorophenyl) -4- (4-chlorophenyl) -4-oxobutanoic acid
sc-506646	2- (4-Chlorophenyl) -2',4'-dichloroacetophenone
TRC-C422060-1G	4-(4-Chlorophenyl)-2-butanone
sc-226381	4- (4-Chlorophenyl) -2-hydroxythiazole