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107772-52-1 | 1-(10H-phenothiazin-2-yl)ethan-1-ol
CAS No: 107772-52-1 Catalog No: AG019L5P MDL No:MFCD01475218
Product Description
Catalog Number:
AG019L5P
Chemical Name:
1-(10H-phenothiazin-2-yl)ethan-1-ol
CAS Number:
107772-52-1
Molecular Formula:
C14H13NOS
Molecular Weight:
243.3241
MDL Number:
MFCD01475218
IUPAC Name:
1-(10H-phenothiazin-2-yl)ethanol
InChI:
InChI=1S/C14H13NOS/c1-9(16)10-6-7-14-12(8-10)15-11-4-2-3-5-13(11)17-14/h2-9,15-16H,1H3
InChI Key:
OQJSSFKWEIGNKG-UHFFFAOYSA-N
SMILES:
CC(c1ccc2c(c1)Nc1c(S2)cccc1)O
NSC Number:
516780
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.072g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
243.324g/mol
Monoisotopic Mass:
243.072g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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