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1782530-47-5 | 2-methyloxane-2-carbaldehyde
CAS No: 1782530-47-5 Catalog No: AG01CAA8 MDL No:MFCD31539769
Product Description
Catalog Number:
AG01CAA8
Chemical Name:
2-methyloxane-2-carbaldehyde
CAS Number:
1782530-47-5
Molecular Formula:
C7H12O2
Molecular Weight:
128.1690
MDL Number:
MFCD31539769
IUPAC Name:
2-methyloxane-2-carbaldehyde
InChI:
InChI=1S/C7H12O2/c1-7(6-8)4-2-3-5-9-7/h6H,2-5H2,1H3
InChI Key:
BAYBMNODWZBBTE-UHFFFAOYSA-N
SMILES:
O=CC1(C)CCCCO1
Properties
Complexity:
112
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.084g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
128.171g/mol
Monoisotopic Mass:
128.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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