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12217-48-0 | ASTRAZON BRILLIANT RED 4G
CAS No: 12217-48-0 Catalog No: AG003NXL MDL No:MFCD00071429
Product Description
Catalog Number:
AG003NXL
Chemical Name:
ASTRAZON BRILLIANT RED 4G
CAS Number:
12217-48-0
MDL Number:
MFCD00071429
IUPAC Name:
3-[N-methyl-4-[(E)-2-(1,3,3-trimethylindol-1-ium-2-yl)ethenyl]anilino]propanenitrile;chloride
InChI:
InChI=1S/C23H26N3.ClH/c1-23(2)20-8-5-6-9-21(20)26(4)22(23)15-12-18-10-13-19(14-11-18)25(3)17-7-16-24;/h5-6,8-15H,7,17H2,1-4H3;1H/q+1;/p-1
InChI Key:
NJIRSTSECXKPCO-UHFFFAOYSA-M
EC Number:
235-399-2
UNII:
0NLQ9APK2S
Properties
Complexity:
598
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
379.182g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
379.932g/mol
Monoisotopic Mass:
379.182g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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