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1217885-83-0

1217885-83-0 | 3-(Fmoc-amino)benzamidoxime

CAS No: 1217885-83-0 Catalog No: AG01FFDD MDL No:

Product Description

Catalog Number:
AG01FFDD
Chemical Name:
3-(Fmoc-amino)benzamidoxime
CAS Number:
1217885-83-0
Molecular Formula:
C22H19N3O3
Molecular Weight:
373.4046
IUPAC Name:
9H-fluoren-9-ylmethyl N-[3-[(E)-N'-hydroxycarbamimidoyl]phenyl]carbamate
InChI:
InChI=1S/C22H19N3O3/c23-21(25-27)14-6-5-7-15(12-14)24-22(26)28-13-20-18-10-3-1-8-16(18)17-9-2-4-11-19(17)20/h1-12,20,27H,13H2,(H2,23,25)(H,24,26)
InChI Key:
WUTFIEQKGGQGMQ-UHFFFAOYSA-N
SMILES:
O/N=C(\c1cccc(c1)NC(=O)OCC1c2ccccc2c2c1cccc2)/N

Properties

Complexity:
559  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
373.143g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
373.412g/mol
Monoisotopic Mass:
373.143g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
96.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  

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