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112770-14-6 | 2-(NAPHTHALEN-2-YLSULFANYL)ACETALDEHYDE
CAS No: 112770-14-6 Catalog No: AG01BIU2 MDL No:MFCD16096714
Product Description
Catalog Number:
AG01BIU2
Chemical Name:
2-(NAPHTHALEN-2-YLSULFANYL)ACETALDEHYDE
CAS Number:
112770-14-6
Molecular Formula:
C12H10OS
Molecular Weight:
202.2722
MDL Number:
MFCD16096714
IUPAC Name:
2-naphthalen-2-ylsulfanylacetaldehyde
InChI:
InChI=1S/C12H10OS/c13-7-8-14-12-6-5-10-3-1-2-4-11(10)9-12/h1-7,9H,8H2
InChI Key:
SQBGQJZMZDVLPL-UHFFFAOYSA-N
SMILES:
O=CCSc1ccc2c(c1)cccc2
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.045g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.271g/mol
Monoisotopic Mass:
202.045g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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