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767616-64-8 | 7-Azabicyclo[2.2.1]heptane-1-carboxylicacid, 3-hydroxy-, (1S,3S,4R)-
CAS No: 767616-64-8 Catalog No: AG005IC9 MDL No:MFCD18828188
Product Description
Catalog Number:
AG005IC9
Chemical Name:
7-Azabicyclo[2.2.1]heptane-1-carboxylicacid, 3-hydroxy-, (1S,3S,4R)-
CAS Number:
767616-64-8
Molecular Formula:
C7H11NO3
Molecular Weight:
157.1671
MDL Number:
MFCD18828188
IUPAC Name:
(1S,3S,4R)-3-hydroxy-7-azabicyclo[2.2.1]heptane-1-carboxylic acid
InChI:
InChI=1S/C7H11NO3/c9-5-3-7(6(10)11)2-1-4(5)8-7/h4-5,8-9H,1-3H2,(H,10,11)/t4-,5+,7+/m1/s1
InChI Key:
FEWLBWFAAPVAFV-ZDLURKLDSA-N
SMILES:
O[C@H]1C[C@]2(N[C@@H]1CC2)C(=O)O
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
157.074g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
157.169g/mol
Monoisotopic Mass:
157.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-3
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