3-Cyclohexene-1-carboxylic acid, 4-methyl-


Chemical Name: 3-Cyclohexene-1-carboxylic acid, 4-methyl-
CAS Number: 4342-60-3
Product Number: AG00DF3H(AGN-PC-0JKF8E)
Synonyms:
MDL No:
Molecular Formula: C8H12O2
Molecular Weight: 140.1797

Identification/Properties


Computed Properties
Molecular Weight:
140.182g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
140.084g/mol
Monoisotopic Mass:
140.084g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
170
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H319
Precautionary Statements:
P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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