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100141-30-8 | Acetamide, N-[2-chloro-4-(1,1-dimethylethyl)phenyl]-
CAS No: 100141-30-8 Catalog No: AG00012U MDL No:MFCD04111072
Product Description
Catalog Number:
AG00012U
Chemical Name:
Acetamide, N-[2-chloro-4-(1,1-dimethylethyl)phenyl]-
CAS Number:
100141-30-8
Molecular Formula:
C12H16ClNO
Molecular Weight:
225.7145
MDL Number:
MFCD04111072
IUPAC Name:
N-(4-tert-butyl-2-chlorophenyl)acetamide
InChI:
InChI=1S/C12H16ClNO/c1-8(15)14-11-6-5-9(7-10(11)13)12(2,3)4/h5-7H,1-4H3,(H,14,15)
InChI Key:
NQEYFCHLAJWJIX-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc(cc1Cl)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:
225.092g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.716g/mol
Monoisotopic Mass:
225.092g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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