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122348-67-8 | N-Isopropylbutyramide
CAS No: 122348-67-8 Catalog No: AG00175J MDL No:MFCD01349261
Product Description
Catalog Number:
AG00175J
Chemical Name:
N-Isopropylbutyramide
CAS Number:
122348-67-8
Molecular Formula:
C7H15NO
Molecular Weight:
129.2001
MDL Number:
MFCD01349261
IUPAC Name:
N-propan-2-ylbutanamide
InChI:
InChI=1S/C7H15NO/c1-4-5-7(9)8-6(2)3/h6H,4-5H2,1-3H3,(H,8,9)
InChI Key:
KKWNADDVIBLENW-UHFFFAOYSA-N
SMILES:
CCCC(=O)NC(C)C
Properties
Complexity:
88.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
129.115g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
129.203g/mol
Monoisotopic Mass:
129.115g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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