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233-74-9 | Naphtho[1,2-d]thiazole
CAS No: 233-74-9 Catalog No: AG002MTL MDL No:
Product Description
Catalog Number:
AG002MTL
Chemical Name:
Naphtho[1,2-d]thiazole
CAS Number:
233-74-9
Molecular Formula:
C11H7NS
Molecular Weight:
185.2450
IUPAC Name:
benzo[e][1,3]benzothiazole
InChI:
InChI=1S/C11H7NS/c1-2-4-9-8(3-1)5-6-10-11(9)12-7-13-10/h1-7H
InChI Key:
KXNQKOAQSGJCQU-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)c1ncsc1cc2
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.03g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.244g/mol
Monoisotopic Mass:
185.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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