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180605-36-1 | Benzenamine, 2-(4-methyl-1-piperazinyl)-
CAS No: 180605-36-1 Catalog No: AG00225P MDL No:MFCD04035359
Product Description
Catalog Number:
AG00225P
Chemical Name:
Benzenamine, 2-(4-methyl-1-piperazinyl)-
CAS Number:
180605-36-1
Molecular Formula:
C11H17N3
Molecular Weight:
191.2728
MDL Number:
MFCD04035359
IUPAC Name:
2-(4-methylpiperazin-1-yl)aniline
InChI:
InChI=1S/C11H17N3/c1-13-6-8-14(9-7-13)11-5-3-2-4-10(11)12/h2-5H,6-9,12H2,1H3
InChI Key:
INWHDRNGZMHXEZ-UHFFFAOYSA-N
SMILES:
CN1CCN(CC1)c1ccccc1N
NSC Number:
145003
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.142g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.278g/mol
Monoisotopic Mass:
191.142g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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