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Methyl 4-(o-tolylazo)-o-tolyl carbonate

HCID 44377
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
63042-08-0
Standard SMILES
COC(=O)Oc1ccc(N=Nc2ccccc2C)cc1C
InChIKey
PHRCREYSBYBYIL-UHFFFAOYSA-N
Molecular formula
C16H16N2O3
Average molar mass
284.31 g/mol
Monoisotopic mass
284.11609238

Names & identifiers

Preferred name
Methyl 4-(o-tolylazo)-o-tolyl carbonate
IUPAC
methyl [2-methyl-4-[(2-methylphenyl)diazenyl]phenyl] carbonate
English name
Carbonic acid methyl 4-(2-methylphenylazo)-2-methylphenyl ester
Molecular formula
C16H16N2O3
Molecular weight
284.31

Names & synonyms

63042-08-0Methyl 4-(o-tolylazo)-o-tolyl carbonate4'-Carbomethoxy-2,3'-dimethylazobenzol4'-Carbomethoxy-2,3'-dimethylazobenzene2,3'-Dimethylazobenzene-4'-methylcarbonateCARBONIC ACID, METHYL 4-(o-TOLYLAZO)-o-TOLYL ESTERCarbonic acid methyl 4-(2-methylphenylazo)-2-methylphenyl esterDB-220256Carbonic acid, methyl 2-methyl-4-[(2-methylphenyl)azo]phenyl ester (9CI)

Database identifiers

CAS
63042-08-0
PubChem CID
44377
Nikkaji
J68.138E

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
60.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
21
Formal charge
0
Complexity
373

Physicochemical properties

Boiling point
426.81 °C · 426.81°C (rough estimate)
Density
1.1418 · 1.1418 (rough estimate)
refractive index
1.624 · 1.6240 (estimate)

Related reactions

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Compound notes

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