2- (2-Methylpropyl) phenol

CAT: 0926-EAA16775-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-EAA16775-01Size:50 mg

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CAS Number

4167-75-3

MDL Number

MFCD12024290

Smiles

CC (C) CC1=CC=CC=C1O

Molecular Formula

C10H14O

Molecular Weight

150.22 g/mol

Controlled

Chemical Information

2-Isobutylphenol

CAS Number	4167-75-3
PubChem CID	93144
IUPAC Name	2-(2-methylpropyl)phenol
Molecular Formula	C10H14O
Molecular Weight	150.22
XLogP	3.3
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	109

SMILES

CC(C)CC1=CC=CC=C1O

InChI

InChI=1S/C10H14O/c1-8(2)7-9-5-3-4-6-10(9)11/h3-6,8,11H,7H2,1-2H3

InChIKey

NFIDBGJMFKNGGQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 4167-75-3

CID: 93144

Formula: C10H14O

MW: 150.22

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	150.22
XLogP3	3.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	150.104465066
Monoisotopic Mass	150.104465066
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	109
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
QEA34419-01	3-[ (2-Methylpropyl) amino]phenol
UQB48137-01	3-{[ (2-Methylpropyl) amino]methyl}phenol
TLB86499-01	[2- (2-Methylpropyl) phenyl]methanamine
XGA22548-01	[2- (2-Methylpropyl) phenyl]methanol
ZDA33391-01	2-[4- (2-Methylpropyl) phenyl]oxirane
FDA05355-01	2- (2-Methylpropyl) azepane
WCA18259-01	2- (2-Methylpropyl) aniline
NAA67097-01	2- (2-Methylpropyl) benzonitrile
AAA58524-01	2-Methylpropyl 2-hydroxypropanoate
KEA31985-01	[4- (2-Methylpropyl) phenyl]methanol

Catalog	Name
TRC-P229555-250MG	4-(2-Methylpropyl)-phenol Phosphate
OR957532	4-[ (2-Methylpropyl) sulfanyl]phenol
OR957531	3-[ (2-Methylpropyl) sulfanyl]phenol
TRC-A620088-250MG	4-(2-Amino-2-methylpropyl)phenol
OR95035-01	4- (2-Amino-2-methylpropyl) phenol
OR1099148-01	2-Bromo-6- (1-methylpropyl) phenol
OR1099804	2-Bromo-4- (1-methylpropyl) phenol
429781-01	4-[ (1S) -1-Amino-2-methylpropyl]phenol
TRC-A617380-250MG	4-[(1S)-1-Amino-2-methylpropyl]phenol
429782-01	4-[ (1S) -1-Amino-2-methylpropyl]phenol-d6