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Home > Aldehydes > 674292-14-9
674292-14-9 | 4H-1-Benzopyran-3-carboxaldehyde, 8-chloro-4-thioxo-
CAS No: 674292-14-9 Catalog No: AG0061Y9 MDL No:
Product Description
Catalog Number:
AG0061Y9
Chemical Name:
4H-1-Benzopyran-3-carboxaldehyde, 8-chloro-4-thioxo-
CAS Number:
674292-14-9
Molecular Formula:
C10H5ClO2S
Molecular Weight:
224.6635
IUPAC Name:
8-chloro-4-sulfanylidenechromene-3-carbaldehyde
InChI:
InChI=1S/C10H5ClO2S/c11-8-3-1-2-7-9(8)13-5-6(4-12)10(7)14/h1-5H
InChI Key:
LLSBGQSMTYNXSB-UHFFFAOYSA-N
SMILES:
O=Cc1coc2c(c1=S)cccc2Cl
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.97g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.658g/mol
Monoisotopic Mass:
223.97g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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