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Home > Aldehydes > 175202-78-5
175202-78-5 | Benzaldehyde, 4-[4-(1,1-dimethylethyl)-2-thiazolyl]-
CAS No: 175202-78-5 Catalog No: AG0020HY MDL No:MFCD00084914
Product Description
Catalog Number:
AG0020HY
Chemical Name:
Benzaldehyde, 4-[4-(1,1-dimethylethyl)-2-thiazolyl]-
CAS Number:
175202-78-5
Molecular Formula:
C14H15NOS
Molecular Weight:
245.3400
MDL Number:
MFCD00084914
IUPAC Name:
4-(4-tert-butyl-1,3-thiazol-2-yl)benzaldehyde
InChI:
InChI=1S/C14H15NOS/c1-14(2,3)12-9-17-13(15-12)11-6-4-10(8-16)5-7-11/h4-9H,1-3H3
InChI Key:
IIKIVYFYAIKVBC-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)c1scc(n1)C(C)(C)C
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.087g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.34g/mol
Monoisotopic Mass:
245.087g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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