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1250423-37-0 | 2-Azabicyclo[2.2.1]heptane-2-acetic acid, ethyl ester
CAS No: 1250423-37-0 Catalog No: AG000N0Z MDL No:
Product Description
Catalog Number:
AG000N0Z
Chemical Name:
2-Azabicyclo[2.2.1]heptane-2-acetic acid, ethyl ester
CAS Number:
1250423-37-0
Molecular Formula:
C10H17NO2
Molecular Weight:
183.2475
IUPAC Name:
ethyl 2-(2-azabicyclo[2.2.1]heptan-2-yl)acetate
InChI:
InChI=1S/C10H17NO2/c1-2-13-10(12)7-11-6-8-3-4-9(11)5-8/h8-9H,2-7H2,1H3
InChI Key:
YZKHJLZDYSGWIT-UHFFFAOYSA-N
SMILES:
CCOC(=O)CN1CC2CC1CC2
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.126g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.251g/mol
Monoisotopic Mass:
183.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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