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144173-07-9 | 3-Pyrrolidinol, 4-azido-1-(phenylmethyl)-, (3R,4R)-rel-
CAS No: 144173-07-9 Catalog No: AG001J1Z MDL No:
Product Description
Catalog Number:
AG001J1Z
Chemical Name:
3-Pyrrolidinol, 4-azido-1-(phenylmethyl)-, (3R,4R)-rel-
CAS Number:
144173-07-9
Molecular Formula:
C11H14N4O
Molecular Weight:
218.2551
IUPAC Name:
4-azido-1-benzylpyrrolidin-3-ol
InChI:
InChI=1S/C11H14N4O/c12-14-13-10-7-15(8-11(10)16)6-9-4-2-1-3-5-9/h1-5,10-11,16H,6-8H2
InChI Key:
LTLHAGYPLWAFQN-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=N[C@@H]1CN(C[C@H]1O)Cc1ccccc1
Properties
Complexity:
271
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.117g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
218.26g/mol
Monoisotopic Mass:
218.117g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
37.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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