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144173-10-4 | 3,6-Diazabicyclo[3.1.0]hexane-6-carboxylic acid, methyl ester
CAS No: 144173-10-4 Catalog No: AG001J1Y MDL No:
Product Description
Catalog Number:
AG001J1Y
Chemical Name:
3,6-Diazabicyclo[3.1.0]hexane-6-carboxylic acid, methyl ester
CAS Number:
144173-10-4
Molecular Formula:
C6H10N2O2
Molecular Weight:
142.1558
IUPAC Name:
methyl 3,6-diazabicyclo[3.1.0]hexane-6-carboxylate
InChI:
InChI=1S/C6H10N2O2/c1-10-6(9)8-4-2-7-3-5(4)8/h4-5,7H,2-3H2,1H3
InChI Key:
UWNMWRNRORDHQG-UHFFFAOYSA-N
SMILES:
COC(=O)N1C2C1CNC2
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.074g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
142.158g/mol
Monoisotopic Mass:
142.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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