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13417-49-7 | 5,6-Dihydro-2H-pyran-3-carbaldehyde
CAS No: 13417-49-7 Catalog No: AG00802L MDL No:MFCD08146636
Product Description
Catalog Number:
AG00802L
Chemical Name:
5,6-Dihydro-2H-pyran-3-carbaldehyde
CAS Number:
13417-49-7
Molecular Formula:
C6H8O2
Molecular Weight:
112.1265
MDL Number:
MFCD08146636
IUPAC Name:
3,6-dihydro-2H-pyran-5-carbaldehyde
InChI:
InChI=1S/C6H8O2/c7-4-6-2-1-3-8-5-6/h2,4H,1,3,5H2
InChI Key:
RKXCKEHBMLDWET-UHFFFAOYSA-N
SMILES:
C1OCCC=C1C=O
EC Number:
236-515-4
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
112.052g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
112.128g/mol
Monoisotopic Mass:
112.052g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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