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7560-64-7

7560-64-7 | 4-METHYLCYCLOHEX-3-ENECARBALDEHYDE

CAS No: 7560-64-7 Catalog No: AG005AOK MDL No:MFCD01451013

Product Description

Catalog Number:
AG005AOK
Chemical Name:
4-METHYLCYCLOHEX-3-ENECARBALDEHYDE
CAS Number:
7560-64-7
Molecular Formula:
C8H12O
Molecular Weight:
124.1803
MDL Number:
MFCD01451013
IUPAC Name:
4-methylcyclohex-3-ene-1-carbaldehyde
InChI:
InChI=1S/C8H12O/c1-7-2-4-8(6-9)5-3-7/h2,6,8H,3-5H2,1H3
InChI Key:
YPHGCKOZJCGDTF-UHFFFAOYSA-N
SMILES:
O=CC1CCC(=CC1)C
EC Number:
231-452-9

Properties

Complexity:
136  
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:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  

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