1,3-Cyclohexadiene, 1-methyl-4-(1-methylethyl)-


Chemical Name: 1,3-Cyclohexadiene, 1-methyl-4-(1-methylethyl)-
CAS Number: 99-86-5
Product Number: AG00IK7I(AGN-PC-0JK83N)
Synonyms:
MDL No:
Molecular Formula: C10H16
Molecular Weight: 136.2340

Identification/Properties


Computed Properties
Molecular Weight:
136.238g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
0
Rotatable Bond Count:
1
Exact Mass:
136.125g/mol
Monoisotopic Mass:
136.125g/mol
Topological Polar Surface Area:
0A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
171
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
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:
Danger
UN#:
2319
Hazard Statements:
H226-H302-H304-H316-H319-H411
Precautionary Statements:
P210-P233-P240-P241+P242+P243-P264-P270-P273-P280-P301+P310+P330+P331-P303+P361+P353-P305+P351+P338+P337+P313-P370+P378-P391-P403+P235-P405-P501
Class:
3
Packing Group:

NMR Spectrum


Other Analytical Data


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