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1936660-32-0 | 4-(2-methylprop-2-en-1-yl)oxane-4-carbaldehyde
CAS No: 1936660-32-0 Catalog No: AG01BIIP MDL No:
Product Description
Catalog Number:
AG01BIIP
Chemical Name:
4-(2-methylprop-2-en-1-yl)oxane-4-carbaldehyde
CAS Number:
1936660-32-0
Molecular Formula:
C10H16O2
Molecular Weight:
168.2328
IUPAC Name:
4-(2-methylprop-2-enyl)oxane-4-carbaldehyde
InChI:
InChI=1S/C10H16O2/c1-9(2)7-10(8-11)3-5-12-6-4-10/h8H,1,3-7H2,2H3
InChI Key:
ULKYGMFCRBLQPL-UHFFFAOYSA-N
SMILES:
O=CC1(CCOCC1)CC(=C)C
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.115g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.236g/mol
Monoisotopic Mass:
168.115g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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