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101976-39-0 | 10H-Phenothiazine, 10-(2-chloropropyl)-
CAS No: 101976-39-0 Catalog No: AG00065G MDL No:
Product Description
Catalog Number:
AG00065G
Chemical Name:
10H-Phenothiazine, 10-(2-chloropropyl)-
CAS Number:
101976-39-0
Molecular Formula:
C15H14ClNS
Molecular Weight:
275.7964
IUPAC Name:
10-(2-chloropropyl)phenothiazine
InChI:
InChI=1S/C15H14ClNS/c1-11(16)10-17-12-6-2-4-8-14(12)18-15-9-5-3-7-13(15)17/h2-9,11H,10H2,1H3
InChI Key:
QCJWEEHOHPZKMR-UHFFFAOYSA-N
SMILES:
CC(CN1c2ccccc2Sc2c1cccc2)Cl
NSC Number:
97887
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.054g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
275.794g/mol
Monoisotopic Mass:
275.054g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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