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100859-81-2 | Propanamide, 3-chloro-N-(1,1-dimethylethyl)-
CAS No: 100859-81-2 Catalog No: AG000310 MDL No:MFCD01353566
Product Description
Catalog Number:
AG000310
Chemical Name:
Propanamide, 3-chloro-N-(1,1-dimethylethyl)-
CAS Number:
100859-81-2
Molecular Formula:
C7H14ClNO
Molecular Weight:
163.6452
MDL Number:
MFCD01353566
IUPAC Name:
N-tert-butyl-3-chloropropanamide
InChI:
InChI=1S/C7H14ClNO/c1-7(2,3)9-6(10)4-5-8/h4-5H2,1-3H3,(H,9,10)
InChI Key:
KZXIRPZPFZEMJA-UHFFFAOYSA-N
SMILES:
ClCCC(=O)NC(C)(C)C
NSC Number:
405612
Properties
Complexity:
117
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.076g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
163.645g/mol
Monoisotopic Mass:
163.076g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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