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Home > Encyclopedia > DIMETHYL5-CHLOROISOPHTHALATE

DIMETHYL5-CHLOROISOPHTHALATE

DIMETHYL5-CHLOROISOPHTHALATE structure

DIMETHYL5-CHLOROISOPHTHALATE 

structure
  • CAS No:

    20330-90-9

  • Formula:

    C10H9ClO4

  • Chemical Name:

    DIMETHYL5-CHLOROISOPHTHALATE

  • Synonyms:

    NSC13963;NISTC20330909;DIMETHYL5-CHLOROISOPHTHALATE;5-Chloro-1,3-benzenedicarboxylicacid1,3-dimethylester

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

DIMETHYL5-CHLOROISOPHTHALATE Basic Attributes

228.63

228.018936

13963

DTXSID10279740

2917399090

Characteristics

52.6

2.3

1.3±0.1 g/cm3

78ºC

316°C at 760 mmHg

132.8±21.3 °C

1.530

Safety Information

20/21/22-36/37/38

26-36/37/39

Xi: Irritant;

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501

H302

|Warning|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:228.63
XLogP3:2.3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:228.0189365
Monoisotopic Mass:228.0189365
Topological Polar Surface Area:52.6
Heavy Atom Count:15
Complexity:230
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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