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116389-86-7 | 2-Propenamide, N-(1,1-dimethylethyl)-N-propyl-
CAS No: 116389-86-7 Catalog No: AG000CDT MDL No:
Product Description
Catalog Number:
AG000CDT
Chemical Name:
2-Propenamide, N-(1,1-dimethylethyl)-N-propyl-
CAS Number:
116389-86-7
Molecular Formula:
C10H19NO
Molecular Weight:
169.2640
IUPAC Name:
N-tert-butyl-N-propylprop-2-enamide
InChI:
InChI=1S/C10H19NO/c1-6-8-11(9(12)7-2)10(3,4)5/h7H,2,6,8H2,1,3-5H3
InChI Key:
OKEXKQIUYJPVNQ-UHFFFAOYSA-N
SMILES:
CCCN(C(C)(C)C)C(=O)C=C
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.147g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.268g/mol
Monoisotopic Mass:
169.147g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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