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Home > Other Heterocycles > 144173-02-4
144173-02-4 | 3,6-Diazabicyclo[3.1.0]hexane, 6-methyl-3-(phenylmethyl)-
CAS No: 144173-02-4 Catalog No: AG001J20 MDL No:
Product Description
Catalog Number:
AG001J20
Chemical Name:
3,6-Diazabicyclo[3.1.0]hexane, 6-methyl-3-(phenylmethyl)-
CAS Number:
144173-02-4
Molecular Formula:
C12H16N2
Molecular Weight:
188.2688
IUPAC Name:
3-benzyl-6-methyl-3,6-diazabicyclo[3.1.0]hexane
InChI:
InChI=1S/C12H16N2/c1-13-11-8-14(9-12(11)13)7-10-5-3-2-4-6-10/h2-6,11-12H,7-9H2,1H3
InChI Key:
XSCWZCWBSUFNLP-UHFFFAOYSA-N
SMILES:
CN1C2C1CN(C2)Cc1ccccc1
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.131g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.274g/mol
Monoisotopic Mass:
188.131g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
6.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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