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Home > Aldehydes > 102386-90-3
102386-90-3 | Cyclohexenecarboxaldehyde, methyl- (9CI)
CAS No: 102386-90-3 Catalog No: AG0007BF MDL No:MFCD24673706
Product Description
Catalog Number:
AG0007BF
Chemical Name:
Cyclohexenecarboxaldehyde, methyl- (9CI)
CAS Number:
102386-90-3
Molecular Formula:
C8H12O
Molecular Weight:
124.1803
MDL Number:
MFCD24673706
IUPAC Name:
2-methylcyclohexene-1-carbaldehyde
InChI:
InChI=1S/C8H12O/c1-7-4-2-3-5-8(7)6-9/h6H,2-5H2,1H3
InChI Key:
SHPCPYUZYHBAMC-UHFFFAOYSA-N
SMILES:
O=CC1=C(C)CCCC1
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.089g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
124.183g/mol
Monoisotopic Mass:
124.089g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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