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55327-29-2 | 2-P-TOLYL-THIAZOLE-4-CARBALDEHYDE
CAS No: 55327-29-2 Catalog No: AG00D8DK MDL No:MFCD06738368
Product Description
Catalog Number:
AG00D8DK
Chemical Name:
2-P-TOLYL-THIAZOLE-4-CARBALDEHYDE
CAS Number:
55327-29-2
Molecular Formula:
C11H9NOS
Molecular Weight:
203.2603
MDL Number:
MFCD06738368
IUPAC Name:
2-(4-methylphenyl)-1,3-thiazole-4-carbaldehyde
InChI:
InChI=1S/C11H9NOS/c1-8-2-4-9(5-3-8)11-12-10(6-13)7-14-11/h2-7H,1H3
InChI Key:
HQQLUNVPMPSCIT-UHFFFAOYSA-N
SMILES:
O=Cc1csc(n1)c1ccc(cc1)C
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.04g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.259g/mol
Monoisotopic Mass:
203.04g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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