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Home > Aldehydes > 1824358-44-2
1824358-44-2 | 4-(1-METHYL-1H-PYRAZOL-4-YL)THIOPHENE-2-CARBALDEHYDE
CAS No: 1824358-44-2 Catalog No: AG01CA2Z MDL No:MFCD22410552
Product Description
Catalog Number:
AG01CA2Z
Chemical Name:
4-(1-METHYL-1H-PYRAZOL-4-YL)THIOPHENE-2-CARBALDEHYDE
CAS Number:
1824358-44-2
Molecular Formula:
C9H8N2OS
Molecular Weight:
192.2376
MDL Number:
MFCD22410552
IUPAC Name:
4-(1-methylpyrazol-4-yl)thiophene-2-carbaldehyde
InChI:
InChI=1S/C9H8N2OS/c1-11-4-8(3-10-11)7-2-9(5-12)13-6-7/h2-6H,1H3
InChI Key:
YMZXTXNXQNPZAK-UHFFFAOYSA-N
SMILES:
O=Cc1scc(c1)c1cnn(c1)C
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.036g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.236g/mol
Monoisotopic Mass:
192.036g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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