o-Toluic acid, 6-(bis(2-chloroethyl)amino)-, methyl ester
methyl 2-[bis(2-chloroethyl)amino]-6-methylbenzoate
Also Known As: o-Toluic acid, 6-(bis(2-chloroethyl)amino)-, methyl ester|methyl 2-[bis(2-chloroethyl)amino]-6-methylbenzoate|6-(Bis(2-chloroethyl)amino)-o-toluic acid methyl ester|Benzoic acid, 6-(bis(2-chloroethyl)amino)-2-methyl-, methyl ester|6-[Bis(2-chloroethyl)amino]-o-toluic acid methyl ester
CAS: 18583-82-9
| Molecular Formula | C13H17Cl2NO2 |
|---|---|
| Molecular Weight | 289.06363 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 289.06363 |
| Monoisotopic Mass | 289.06363 |
| Heavy Atoms | 18 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 18583-82-9 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)N(CCCl)CCCl)C(=O)OC |
| InChIKey | JYOLRWHQHHSQGQ-UHFFFAOYSA-N |
Product Overview
o-Toluic acid, 6-(bis(2-chloroethyl)amino)-, methyl ester (CAS 18583-82-9), with molecular formula C13H17Cl2NO2 and molecular weight 289.06363 g/mol. IUPAC: methyl 2-[bis(2-chloroethyl)amino]-6-methylbenzoate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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o-Toluic acid, 6-(bis(2-chloroethyl)amino)-, methyl ester is a custom synthesis product. We offer services from milligram to kilogram scale.
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