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101976-28-7 | 10H-Phenothiazine, 2-chloro-10-(2-chloropropyl)-
CAS No: 101976-28-7 Catalog No: AG00064B MDL No:
Product Description
Catalog Number:
AG00064B
Chemical Name:
10H-Phenothiazine, 2-chloro-10-(2-chloropropyl)-
CAS Number:
101976-28-7
Molecular Formula:
C15H13Cl2NS
Molecular Weight:
310.2414
IUPAC Name:
2-chloro-10-(2-chloropropyl)phenothiazine
InChI:
InChI=1S/C15H13Cl2NS/c1-10(16)9-18-12-4-2-3-5-14(12)19-15-7-6-11(17)8-13(15)18/h2-8,10H,9H2,1H3
InChI Key:
WMLOGBMMUXVWHK-UHFFFAOYSA-N
SMILES:
CC(CN1c2cc(Cl)ccc2Sc2c1cccc2)Cl
NSC Number:
106886
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.015g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
310.236g/mol
Monoisotopic Mass:
309.015g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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