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113395-73-6 | 10H-Phenothiazine-10-propanal, 2-chloro-, oxime, (Z)- (9CI)
CAS No: 113395-73-6 Catalog No: AG0008F8 MDL No:
Product Description
Catalog Number:
AG0008F8
Chemical Name:
10H-Phenothiazine-10-propanal, 2-chloro-, oxime, (Z)- (9CI)
CAS Number:
113395-73-6
Molecular Formula:
C15H13ClN2OS
Molecular Weight:
304.7945
IUPAC Name:
N-[3-(2-chlorophenothiazin-10-yl)propylidene]hydroxylamine
InChI:
InChI=1S/C15H13ClN2OS/c16-11-6-7-15-13(10-11)18(9-3-8-17-19)12-4-1-2-5-14(12)20-15/h1-2,4-8,10,19H,3,9H2
InChI Key:
RSGZUDWPNXWJMV-UHFFFAOYSA-N
SMILES:
O/N=C\CCN1c2ccccc2Sc2c1cc(Cl)cc2
Properties
Complexity:
355
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.044g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
304.792g/mol
Monoisotopic Mass:
304.044g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
61.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.5
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