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101751-95-5 | 1-Piperazinepropanamine, N,N-diethyl-4-phenyl-
CAS No: 101751-95-5 Catalog No: AG0005EN MDL No:
Product Description
Catalog Number:
AG0005EN
Chemical Name:
1-Piperazinepropanamine, N,N-diethyl-4-phenyl-
CAS Number:
101751-95-5
Molecular Formula:
C17H29N3
Molecular Weight:
275.4323
IUPAC Name:
N,N-diethyl-3-(4-phenylpiperazin-1-yl)propan-1-amine
InChI:
InChI=1S/C17H29N3/c1-3-18(4-2)11-8-12-19-13-15-20(16-14-19)17-9-6-5-7-10-17/h5-7,9-10H,3-4,8,11-16H2,1-2H3
InChI Key:
NLJPTKGVXAQZAN-UHFFFAOYSA-N
SMILES:
CCN(CCCN1CCN(CC1)c1ccccc1)CC
NSC Number:
87941
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.236g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
275.44g/mol
Monoisotopic Mass:
275.236g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
9.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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