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Home > Other Heterocycles > 84508-86-1
84508-86-1 | 4-(7,8-dioxa-3-azabicyclo[3.2.1]oct-1-yl)benzoic acid hydrochloride
CAS No: 84508-86-1 Catalog No: AG00GPZR MDL No:
Product Description
Catalog Number:
AG00GPZR
Chemical Name:
4-(7,8-dioxa-3-azabicyclo[3.2.1]oct-1-yl)benzoic acid hydrochloride
CAS Number:
84508-86-1
IUPAC Name:
4-(6,8-dioxa-3-azabicyclo[3.2.1]octan-5-yl)benzoic acid;hydrochloride
InChI:
InChI=1S/C12H13NO4.ClH/c14-11(15)8-1-3-9(4-2-8)12-7-13-5-10(17-12)6-16-12;/h1-4,10,13H,5-7H2,(H,14,15);1H
InChI Key:
IOGWTMOHMQPGIK-UHFFFAOYSA-N
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.061g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
271.697g/mol
Monoisotopic Mass:
271.061g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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