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1261489-15-9 | 3,4-dihydro-1H-2-benzopyran-5-carbaldehyde
CAS No: 1261489-15-9 Catalog No: AG01BHWK MDL No:MFCD18416381
Product Description
Catalog Number:
AG01BHWK
Chemical Name:
3,4-dihydro-1H-2-benzopyran-5-carbaldehyde
CAS Number:
1261489-15-9
Molecular Formula:
C10H10O2
Molecular Weight:
162.1852
MDL Number:
MFCD18416381
IUPAC Name:
3,4-dihydro-1H-isochromene-5-carbaldehyde
InChI:
InChI=1S/C10H10O2/c11-6-8-2-1-3-9-7-12-5-4-10(8)9/h1-3,6H,4-5,7H2
InChI Key:
PYDURGONWJHTRT-UHFFFAOYSA-N
SMILES:
O=Cc1cccc2c1CCOC2
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.068g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.188g/mol
Monoisotopic Mass:
162.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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