α-Methyl-α- (1-methylethyl) benzenemethanol

CAT: 0127-OR1098191-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1098191-01Size:250 mg

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CAS Number

4383-11-3

MDL Number

MFCD01013588

Purity

95%

Smiles

C (C (C) C) (C) (O) c1ccccc1

Chemical Information

3-Methyl-2-phenylbutan-2-ol

CAS Number	4383-11-3
PubChem CID	138212
IUPAC Name	3-methyl-2-phenylbutan-2-ol
Molecular Formula	C11H16O
Molecular Weight	164.24
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	12
Formal Charge	0
Complexity	136

SMILES

CC(C)C(C)(C1=CC=CC=C1)O

InChI

InChI=1S/C11H16O/c1-9(2)11(3,12)10-7-5-4-6-8-10/h4-9,12H,1-3H3

InChIKey

KZVSJCRPDWUPEP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 4383-11-3

CID: 138212

Formula: C11H16O

MW: 164.24

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	164.24
XLogP3	2.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	164.120115130
Monoisotopic Mass	164.120115130
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	136
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
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OR1083199-01	α-Methyl-α- (1-methylethyl) -2- (methylthio) benzenemethanol
OR1083177	α-Methyl-α- (1-methylethyl) -4- (methylthio) benzenemethanol
OR1083661	α-Cyclopropyl-α-methyl-3- (1-methylethyl) benzenemethanol
OR1094761-01	2-Methyl-α, α-bis (1-methylethyl) benzenemethanol
OR1096851-01	α-Methyl-α- (1-methylethyl) -3- (methylthio) benzenemethanol
OR1083183-01	α-Ethyl-α-methyl-3- (1-methylethyl) benzenemethanol
OR1082563-01	α-Cyclopropyl-α-methyl-4- (1-methylethyl) benzenemethanol
OR1083645	α-Methyl-α,3-bis (1-methylethyl) benzenemethanol

Catalog	Name
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423922-01	3-Amino-α-[[[2- (4-methoxy-3-methylphenyl) -1-methylethyl] (phenylmethyl) amino]methyl]-4- (phenylmethoxy) benzenemethanol
TRC-M268370-50MG	a-[[[2-(4-Methoxy-3-methylphenyl)-1-methylethyl](phenylmethyl)amino]methyl]-3-nitro-4-(phenylmethoxy)benzenemethanol