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700376-57-4 | (1R,3S,5R);-2-Azabicyclo[3.1.0]hexane-3-carboxamide
CAS No: 700376-57-4 Catalog No: AG0064OF MDL No:MFCD13151929
Product Description
Catalog Number:
AG0064OF
Chemical Name:
(1R,3S,5R);-2-Azabicyclo[3.1.0]hexane-3-carboxamide
CAS Number:
700376-57-4
Molecular Formula:
C6H10N2O
Molecular Weight:
126.1564
MDL Number:
MFCD13151929
IUPAC Name:
(1R,3S,5R)-2-azabicyclo[3.1.0]hexane-3-carboxamide
InChI:
InChI=1S/C6H10N2O/c7-6(9)5-2-3-1-4(3)8-5/h3-5,8H,1-2H2,(H2,7,9)/t3-,4-,5+/m1/s1
InChI Key:
MCEWPPMUTVLMJG-WDCZJNDASA-N
SMILES:
NC(=O)[C@@H]1C[C@@H]2[C@H](N1)C2
Properties
Complexity:
157
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
126.079g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
126.159g/mol
Monoisotopic Mass:
126.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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