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Home > Aldehydes > 2059994-51-1
2059994-51-1 | 3-acetylcyclobutane-1-carbaldehyde
CAS No: 2059994-51-1 Catalog No: AG01BW4A MDL No:MFCD30476764
Product Description
Catalog Number:
AG01BW4A
Chemical Name:
3-acetylcyclobutane-1-carbaldehyde
CAS Number:
2059994-51-1
Molecular Formula:
C7H10O2
Molecular Weight:
126.1531
MDL Number:
MFCD30476764
IUPAC Name:
3-acetylcyclobutane-1-carbaldehyde
InChI:
InChI=1S/C7H10O2/c1-5(9)7-2-6(3-7)4-8/h4,6-7H,2-3H2,1H3
InChI Key:
IDOTWDKQUGAGEV-UHFFFAOYSA-N
SMILES:
O=CC1CC(C1)C(=O)C
Properties
Complexity:
134
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.068g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
126.155g/mol
Monoisotopic Mass:
126.068g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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