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Home > Aldehydes > 1000993-65-6
1000993-65-6 | 2-Furancarboxaldehyde, 5-methyl-4-(1-methylethyl)-
CAS No: 1000993-65-6 Catalog No: AG0000X2 MDL No:
Product Description
Catalog Number:
AG0000X2
Chemical Name:
2-Furancarboxaldehyde, 5-methyl-4-(1-methylethyl)-
CAS Number:
1000993-65-6
Molecular Formula:
C9H12O2
Molecular Weight:
152.1904
IUPAC Name:
5-methyl-4-propan-2-ylfuran-2-carbaldehyde
InChI:
InChI=1S/C9H12O2/c1-6(2)9-4-8(5-10)11-7(9)3/h4-6H,1-3H3
InChI Key:
NZQDZGDPNMUECU-UHFFFAOYSA-N
SMILES:
O=Cc1cc(c(o1)C)C(C)C
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.084g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.193g/mol
Monoisotopic Mass:
152.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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