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N- (2,4-Dimethylphenyl) Formamide

CAT: 0127-OR1027596-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1027596-01Size:100 mg
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CAS Number
60397-77-5
Synonyms
N- (2,4-dimethylphenyl) formamide
Purity
97%
Smiles
CC1=CC(=C(C=C1)NC=O)C

Chemical Information

N-(2,4-Dimethylphenyl)formamide

N-(2,4-dimethylphenyl)formamide is a methylbenzene.

CAS Number60397-77-5
PubChem CID92363
IUPAC NameN-(2,4-dimethylphenyl)formamide
Molecular FormulaC9H11NO
Molecular Weight149.19
XLogP1.5
Topological Polar Surface Area29.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count11
Formal Charge0
Complexity136
SMILES
CC1=CC(=C(C=C1)NC=O)C
InChI
InChI=1S/C9H11NO/c1-7-3-4-9(10-6-11)8(2)5-7/h3-6H,1-2H3,(H,10,11)
InChIKey
JOFDPSBOUCXJCC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(2,4-Dimethylphenyl)formamide
CAS: 60397-77-5
CID: 92363
Formula: C9H11NO
MW: 149.19
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight149.19
XLogP31.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass149.084063974
Monoisotopic Mass149.084063974
Topological Polar Surface Area29.1 Ų
Heavy Atom Count11
Formal Charge0
Complexity136
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