Home Aldehydes Benzaldehyde, 4-[(2-methoxyphenyl)thio]-

Benzaldehyde, 4-[(2-methoxyphenyl)thio]-

CAS No.:
477256-35-2
Catalog Number:
AG00I8OU
Molecular Formula:
C14H12O2S
Molecular Weight:
244.3089
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Product Description
Catalog Number:
AG00I8OU
Chemical Name:
Benzaldehyde, 4-[(2-methoxyphenyl)thio]-
CAS Number:
477256-35-2
Molecular Formula:
C14H12O2S
Molecular Weight:
244.3089
MDL Number:
MFCD18620954
IUPAC Name:
4-(2-methoxyphenyl)sulfanylbenzaldehyde
InChI:
InChI=1S/C14H12O2S/c1-16-13-4-2-3-5-14(13)17-12-8-6-11(10-15)7-9-12/h2-10H,1H3
InChI Key:
GMESLFAYLNRVQM-UHFFFAOYSA-N
SMILES:
COc1ccccc1Sc1ccc(cc1)C=O
Properties
Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.056g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.308g/mol
Monoisotopic Mass:
244.056g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
51.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties