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4-methylquinolin-2 (1H) -one

CAT: 1266-JH367505Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1266-JH367505Size:1 Each
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CAS Number
607-66-9
UN Code
UN 3077
Hazard Statement
Xi
Stability
Stable. Incompatible with strong oxidizing agents.
Molecular Formula
C10H9NO
Molecular Weight
159.18
Product Name Synonym
4-METHYL-2-QUINOLINOL
Physical Properties
White to light yellow crystal powder
Hazardous Class
6.1
Safety Statements
S24/25
Density
1.136 g/cm3
Flash Point
201.8oC
RIDADR
UN 3077
Melting Point
224-229oC

Chemical Information

4-Methylquinolin-2-ol

4-methylquinolin-2(1H)-one is a quinolone that is quinolin-2(1H)-one substituted by a methyl group at position 4.

CAS Number607-66-9
PubChem CID69088
IUPAC Name4-methyl-1H-quinolin-2-one
Molecular FormulaC10H9NO
Molecular Weight159.18
XLogP1.2
Topological Polar Surface Area29.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count12
Formal Charge0
Complexity232
SMILES
CC1=CC(=O)NC2=CC=CC=C12
InChI
InChI=1S/C10H9NO/c1-7-6-10(12)11-9-5-3-2-4-8(7)9/h2-6H,1H3,(H,11,12)
InChIKey
APLVPBUBDFWWAD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Methylquinolin-2-ol
CAS: 607-66-9
CID: 69088
Formula: C10H9NO
MW: 159.18
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight159.18
XLogP31.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass159.068413911
Monoisotopic Mass159.068413911
Topological Polar Surface Area29.1 Ų
Heavy Atom Count12
Formal Charge0
Complexity232
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

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OR1028513-012-Methylquinolin-4 (1H) -One
JBA49754-013-Hydroxy-2-methylquinolin-4 (1H) -one
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OR26332-014-Chloro-1-methylquinolin-2 (1H) -one
QAA644898-Methoxy-2-methylquinolin-4 (1H) -one
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