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New Red

CAS No.:
220658-76-4
Catalog Number:
AG00BDDY
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00BDDY
Chemical Name:
New Red
CAS Number:
220658-76-4
MDL Number:
MFCD31735103
IUPAC Name:
trisodium;5-acetamido-4-hydroxy-3-[(4-sulfonatophenyl)diazenyl]naphthalene-2,7-disulfonate
InChI:
InChI=1S/C18H15N3O11S3.3Na/c1-9(22)19-14-8-13(34(27,28)29)6-10-7-15(35(30,31)32)17(18(23)16(10)14)21-20-11-2-4-12(5-3-11)33(24,25)26;;;/h2-8,23H,1H3,(H,19,22)(H,24,25,26)(H,27,28,29)(H,30,31,32);;;/q;3*+1/p-3
InChI Key:
PZAILUSNQOUEQZ-UHFFFAOYSA-K
Properties
Complexity:
1090  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
4  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
610.933g/mol
Formal Charge:
0
Heavy Atom Count:
38  
Hydrogen Bond Acceptor Count:
13  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
611.453g/mol
Monoisotopic Mass:
610.933g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
271A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties