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232-81-5 | Naphtho[1,2-c]thiophene
CAS No: 232-81-5 Catalog No: AG002MIB MDL No:
Product Description
Catalog Number:
AG002MIB
Chemical Name:
Naphtho[1,2-c]thiophene
CAS Number:
232-81-5
Molecular Formula:
C12H8S
Molecular Weight:
184.2569
IUPAC Name:
benzo[g][2]benzothiole
InChI:
InChI=1S/C12H8S/c1-2-4-11-9(3-1)5-6-10-7-13-8-12(10)11/h1-8H
InChI Key:
YPEFMQGGABUYFX-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)c1cscc1cc2
NSC Number:
241116
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.035g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.256g/mol
Monoisotopic Mass:
184.035g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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