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866821-26-3 | 5-[(2-Chlorobenzyl)amino]-5-oxopentanoic acid
CAS No: 866821-26-3 Catalog No: AG01FOCL MDL No:
Product Description
Catalog Number:
AG01FOCL
Chemical Name:
5-[(2-Chlorobenzyl)amino]-5-oxopentanoic acid
CAS Number:
866821-26-3
IUPAC Name:
5-[(2-chlorophenyl)methylamino]-5-oxopentanoic acid
InChI:
InChI=1S/C12H14ClNO3/c13-10-5-2-1-4-9(10)8-14-11(15)6-3-7-12(16)17/h1-2,4-5H,3,6-8H2,(H,14,15)(H,16,17)
InChI Key:
WSRZWWVHZMLUGL-UHFFFAOYSA-N
Properties
Complexity:
271
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.066g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
255.698g/mol
Monoisotopic Mass:
255.066g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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