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Home > Aldehydes > 1007847-72-4
1007847-72-4 | Benzaldehyde, 4-(2-thienylmethyl)-
CAS No: 1007847-72-4 Catalog No: AG0002US MDL No:
Product Description
Catalog Number:
AG0002US
Chemical Name:
Benzaldehyde, 4-(2-thienylmethyl)-
CAS Number:
1007847-72-4
Molecular Formula:
C12H10OS
Molecular Weight:
202.2722
IUPAC Name:
4-(thiophen-2-ylmethyl)benzaldehyde
InChI:
InChI=1S/C12H10OS/c13-9-11-5-3-10(4-6-11)8-12-2-1-7-14-12/h1-7,9H,8H2
InChI Key:
COVDNSXFIDXCDX-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)Cc1cccs1
Properties
Complexity:
185
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:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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