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7401-05-0 | 1-Piperazinecarboxamide,N-ethyl-4-methyl-
CAS No: 7401-05-0 Catalog No: AG005IJJ MDL No:
Product Description
Catalog Number:
AG005IJJ
Chemical Name:
1-Piperazinecarboxamide,N-ethyl-4-methyl-
CAS Number:
7401-05-0
Molecular Formula:
C8H17N3O
Molecular Weight:
171.2401
IUPAC Name:
N-ethyl-4-methylpiperazine-1-carboxamide
InChI:
InChI=1S/C8H17N3O/c1-3-9-8(12)11-6-4-10(2)5-7-11/h3-7H2,1-2H3,(H,9,12)
InChI Key:
JNGRMEMVULIXBF-UHFFFAOYSA-N
SMILES:
CCNC(=O)N1CCN(CC1)C
NSC Number:
37242
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.137g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
171.244g/mol
Monoisotopic Mass:
171.137g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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