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1083300-27-9 | 3-(4-THIAZOLYL)-BENZALDEHYDE
CAS No: 1083300-27-9 Catalog No: AG01CA0T MDL No:MFCD27941387
Product Description
Catalog Number:
AG01CA0T
Chemical Name:
3-(4-THIAZOLYL)-BENZALDEHYDE
CAS Number:
1083300-27-9
Molecular Formula:
C10H7NOS
Molecular Weight:
189.2337
MDL Number:
MFCD27941387
IUPAC Name:
3-(1,3-thiazol-4-yl)benzaldehyde
InChI:
InChI=1S/C10H7NOS/c12-5-8-2-1-3-9(4-8)10-6-13-7-11-10/h1-7H
InChI Key:
XAMHFYWFBZGYNP-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)c1cscn1
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.025g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.232g/mol
Monoisotopic Mass:
189.025g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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