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87995-50-4 | Propanamide, N-(2-bromo-4-methylphenyl)-2,2-dimethyl-
CAS No: 87995-50-4 Catalog No: AG004O7K MDL No:
Product Description
Catalog Number:
AG004O7K
Chemical Name:
Propanamide, N-(2-bromo-4-methylphenyl)-2,2-dimethyl-
CAS Number:
87995-50-4
Molecular Formula:
C12H16BrNO
Molecular Weight:
270.1655
IUPAC Name:
N-(2-bromo-4-methylphenyl)-2,2-dimethylpropanamide
InChI:
InChI=1S/C12H16BrNO/c1-8-5-6-10(9(13)7-8)14-11(15)12(2,3)4/h5-7H,1-4H3,(H,14,15)
InChI Key:
HBNZGZDYMNYJMC-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)Br)NC(=O)C(C)(C)C
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.042g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
270.17g/mol
Monoisotopic Mass:
269.042g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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