4-[3-(2-Chloroethyl)-3-nitrosoureido]-2,6-dimethylbenzoic acid

Modify Date: 2025-12-01 11:42:21

4-[3-(2-Chloroethyl)-3-nitrosoureido]-2,6-dimethylbenzoic acid Structure
4-[3-(2-Chloroethyl)-3-nitrosoureido]-2,6-dimethylbenzoic acid structure
Common Name 4-[3-(2-Chloroethyl)-3-nitrosoureido]-2,6-dimethylbenzoic acid
CAS Number 33054-79-4 Molecular Weight 299.71000
Density 1.39g/cm3 Boiling Point N/A
Molecular Formula C12H14ClN3O4 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 4-[[2-chloroethyl(nitroso)carbamoyl]amino]-2,6-dimethylbenzoic acid

 Chemical & Physical Properties

Density 1.39g/cm3
Molecular Formula C12H14ClN3O4
Molecular Weight 299.71000
Exact Mass 299.06700
PSA 99.07000
LogP 2.82870
Index of Refraction 1.597
InChIKey LHXROPALKCXVAZ-UHFFFAOYSA-N
SMILES Cc1cc(NC(=O)N(CCCl)N=O)cc(C)c1C(=O)O
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