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3138-90-7 | 1-Benzyl-3-methylpiperazine
CAS No: 3138-90-7 Catalog No: AG003DZL MDL No:MFCD01570796
Product Description
Catalog Number:
AG003DZL
Chemical Name:
1-Benzyl-3-methylpiperazine
CAS Number:
3138-90-7
Molecular Formula:
C12H18N2
Molecular Weight:
190.2847
MDL Number:
MFCD01570796
IUPAC Name:
1-benzyl-3-methylpiperazine
InChI:
InChI=1S/C12H18N2/c1-11-9-14(8-7-13-11)10-12-5-3-2-4-6-12/h2-6,11,13H,7-10H2,1H3
InChI Key:
QOFUDSPYJDXBOF-UHFFFAOYSA-N
SMILES:
CC1NCCN(C1)Cc1ccccc1
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.147g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.29g/mol
Monoisotopic Mass:
190.147g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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