Home Other Building Blocks 5-Nitro BAPTA, tetraMethyl ester

5-Nitro BAPTA, tetraMethyl ester

CAS No.:
172646-43-4
Catalog Number:
AG00ALVE
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00ALVE
Chemical Name:
5-Nitro BAPTA, tetraMethyl ester
CAS Number:
172646-43-4
MDL Number:
MFCD28358710
IUPAC Name:
methyl 2-[2-[2-[2-[bis(2-methoxy-2-oxoethyl)amino]phenoxy]ethoxy]-N-(2-methoxy-2-oxoethyl)-4-nitroanilino]acetate
InChI:
InChI=1S/C26H31N3O12/c1-36-23(30)14-27(15-24(31)37-2)19-7-5-6-8-21(19)40-11-12-41-22-13-18(29(34)35)9-10-20(22)28(16-25(32)38-3)17-26(33)39-4/h5-10,13H,11-12,14-17H2,1-4H3
InChI Key:
SKSQLUXELUIUKW-UHFFFAOYSA-N
Properties
Complexity:
846  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
577.191g/mol
Formal Charge:
0
Heavy Atom Count:
41  
Hydrogen Bond Acceptor Count:
14  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
577.543g/mol
Monoisotopic Mass:
577.191g/mol
Rotatable Bond Count:
19  
Topological Polar Surface Area:
176A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties