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1363383-32-7 | 2-Azaspiro[3.3]heptane-2-carboxylic acid, 6-hydroxy-, phenylmethyl ester
CAS No: 1363383-32-7 Catalog No: AG0011RK MDL No:MFCD22415206
Product Description
Catalog Number:
AG0011RK
Chemical Name:
2-Azaspiro[3.3]heptane-2-carboxylic acid, 6-hydroxy-, phenylmethyl ester
CAS Number:
1363383-32-7
Molecular Formula:
C14H17NO3
Molecular Weight:
247.2897
MDL Number:
MFCD22415206
IUPAC Name:
benzyl 6-hydroxy-2-azaspiro[3.3]heptane-2-carboxylate
InChI:
InChI=1S/C14H17NO3/c16-12-6-14(7-12)9-15(10-14)13(17)18-8-11-4-2-1-3-5-11/h1-5,12,16H,6-10H2
InChI Key:
OPHVFICSPMLQLE-UHFFFAOYSA-N
SMILES:
OC1CC2(C1)CN(C2)C(=O)OCc1ccccc1
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.121g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
247.294g/mol
Monoisotopic Mass:
247.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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