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Home > Nitro Compounds > 74834-94-9
74834-94-9 | 10H-Phenothiazine, 3-methoxy-7-methyl-1-nitro-
CAS No: 74834-94-9 Catalog No: AG005GVW MDL No:
Product Description
Catalog Number:
AG005GVW
Chemical Name:
10H-Phenothiazine, 3-methoxy-7-methyl-1-nitro-
CAS Number:
74834-94-9
Molecular Formula:
C14H12N2O3S
Molecular Weight:
288.3217
IUPAC Name:
3-methoxy-7-methyl-1-nitro-10H-phenothiazine
InChI:
InChI=1S/C14H12N2O3S/c1-8-3-4-10-12(5-8)20-13-7-9(19-2)6-11(16(17)18)14(13)15-10/h3-7,15H,1-2H3
InChI Key:
SLZLPDIHSFUHJO-UHFFFAOYSA-N
SMILES:
COc1cc2Sc3cc(C)ccc3Nc2c(c1)[N+](=O)[O-]
Properties
Complexity:
376
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.057g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
288.321g/mol
Monoisotopic Mass:
288.057g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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