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Home > Aldehydes > 133047-46-8
133047-46-8 | 4-Thiazolecarboxaldehyde, 2-(1-methylethyl)-
CAS No: 133047-46-8 Catalog No: AG0011K9 MDL No:MFCD06660125
Product Description
Catalog Number:
AG0011K9
Chemical Name:
4-Thiazolecarboxaldehyde, 2-(1-methylethyl)-
CAS Number:
133047-46-8
Molecular Formula:
C7H9NOS
Molecular Weight:
155.2175
MDL Number:
MFCD06660125
IUPAC Name:
2-propan-2-yl-1,3-thiazole-4-carbaldehyde
InChI:
InChI=1S/C7H9NOS/c1-5(2)7-8-6(3-9)4-10-7/h3-5H,1-2H3
InChI Key:
NUEZKCPTDMEROB-UHFFFAOYSA-N
SMILES:
O=Cc1csc(n1)C(C)C
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.04g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
155.215g/mol
Monoisotopic Mass:
155.04g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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