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89240-30-2 | 5-Benzofurancarboxaldehyde, 2,3-dihydro-6,7-dimethyl-
CAS No: 89240-30-2 Catalog No: AG00432L MDL No:
Product Description
Catalog Number:
AG00432L
Chemical Name:
5-Benzofurancarboxaldehyde, 2,3-dihydro-6,7-dimethyl-
CAS Number:
89240-30-2
Molecular Formula:
C11H12O2
Molecular Weight:
176.2118
IUPAC Name:
6,7-dimethyl-2,3-dihydro-1-benzofuran-5-carbaldehyde
InChI:
InChI=1S/C11H12O2/c1-7-8(2)11-9(3-4-13-11)5-10(7)6-12/h5-6H,3-4H2,1-2H3
InChI Key:
CHRYENKZIXRZMQ-UHFFFAOYSA-N
SMILES:
O=Cc1cc2CCOc2c(c1C)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:
176.084g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.215g/mol
Monoisotopic Mass:
176.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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