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Home > Other Heterocycles > 102280-69-3
102280-69-3 | Carbamic acid, 1-azabicyclo[2.2.2]oct-3-yl-, ethyl ester (9CI)
CAS No: 102280-69-3 Catalog No: AG00073D MDL No:
Product Description
Catalog Number:
AG00073D
Chemical Name:
Carbamic acid, 1-azabicyclo[2.2.2]oct-3-yl-, ethyl ester (9CI)
CAS Number:
102280-69-3
Molecular Formula:
C10H18N2O2
Molecular Weight:
198.2621
IUPAC Name:
ethyl N-(1-azabicyclo[2.2.2]octan-3-yl)carbamate
InChI:
InChI=1S/C10H18N2O2/c1-2-14-10(13)11-9-7-12-5-3-8(9)4-6-12/h8-9H,2-7H2,1H3,(H,11,13)
InChI Key:
YFWYOKRKIOWLBK-UHFFFAOYSA-N
SMILES:
CCOC(=O)NC1CN2CCC1CC2
NSC Number:
664539
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.137g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.266g/mol
Monoisotopic Mass:
198.137g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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