2-Ethyl-5-methylphenol

CAT: 0572-TRC-B439795-25MGSize: 25 mgDry Ice: NoHazardous: No

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CAT#:0572-TRC-B439795-25MGSize:25 mg

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

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CAS Number

1687-61-2

Hazard Statement

Harmful if swallowed.

Purity

>95% (HPLC)

Smiles

CCc1ccc(C)cc1O

Molecular Formula

C9H12O

Molecular Weight

136.19

Shipping Conditions

Room Temperature

Storage Conditions

-20°C

Chemical Information

2-Ethyl-5-methylphenol

2-Ethyl-5-methylphenol is a hydroxytoluene.

CAS Number	1687-61-2
PubChem CID	15523
IUPAC Name	2-ethyl-5-methylphenol
Molecular Formula	C9H12O
Molecular Weight	136.19
XLogP	2.8
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	10
Formal Charge	0
Complexity	101

SMILES

CCC1=C(C=C(C=C1)C)O

InChI

InChI=1S/C9H12O/c1-3-8-5-4-7(2)6-9(8)10/h4-6,10H,3H2,1-2H3

InChIKey

LTRVUFFOMIUCPJ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1687-61-2

CID: 15523

Formula: C9H12O

MW: 136.19

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	136.19
XLogP3	2.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	136.088815002
Monoisotopic Mass	136.088815002
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	101
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

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Alternative Products

Catalog	Name
BAA68761-01	2-Ethyl-5-methylphenol
MBS5779035	3-Ethyl-5-methylphenol
OR1064746-01	5-Ethyl-2-methoxy-4-methylphenol
CAA21973-01	4-Ethyl-2-methylphenol
OR0472-01	2-Ethyl-6-methylphenol
OR1045584-01	2-Ethyl-4-methylphenol
HY-W089538R	2-Ethyl-6-methylphenol (Standard)
IHA80306-01	5-Iodo-2-methylphenol
FA67402-01	2-Amino-5-methylphenol
435498-01	5-Bromo-2-methylphenol

2-Ethyl-5-methylphenol

Chemical Information

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