Home Aldehydes 3-Thiazol-2-yl-benzaldehyde

3-Thiazol-2-yl-benzaldehyde

CAS No.:
885465-97-4
Catalog Number:
AG008BTL
Molecular Formula:
C10H7NOS
Molecular Weight:
189.2337
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Product Description
Catalog Number:
AG008BTL
Chemical Name:
3-Thiazol-2-yl-benzaldehyde
CAS Number:
885465-97-4
Molecular Formula:
C10H7NOS
Molecular Weight:
189.2337
MDL Number:
MFCD06797781
IUPAC Name:
3-(1,3-thiazol-2-yl)benzaldehyde
InChI:
InChI=1S/C10H7NOS/c12-7-8-2-1-3-9(6-8)10-11-4-5-13-10/h1-7H
InChI Key:
YJMGIEKCDQXKKZ-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)c1nccs1
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  
Properties