Cas no 93762-14-2 (1,2-Benzenedicarboxylicacid, mono(2-methylpropyl) ester, sodium salt (9CI))

1,2-Benzenedicarboxylicacid, mono(2-methylpropyl) ester, sodium salt (9CI) structure
93762-14-2 structure
Product Name:1,2-Benzenedicarboxylicacid, mono(2-methylpropyl) ester, sodium salt (9CI)
CAS No:93762-14-2
MF:C12H13NaO4
MW:244.218994855881
CID:815323
PubChem ID:23662570
Update Time:2025-04-19

1,2-Benzenedicarboxylicacid, mono(2-methylpropyl) ester, sodium salt (9CI) Chemical and Physical Properties

Names and Identifiers

    • 1,2-Benzenedicarboxylicacid, mono(2-methylpropyl) ester, sodium salt (9CI)
    • sodium isobutyl phthalate
    • sodium,2-(2-methylpropoxycarbonyl)benzoate
    • DTXSID80239573
    • NS00091848
    • FZE35P8CV4
    • EINECS 297-728-6
    • 1,2-Benzenedicarboxylic acid, mono(2-methylpropyl) ester, sodium salt
    • 93762-14-2
    • Inchi: 1S/C12H14O4.Na/c1-8(2)7-16-12(15)10-6-4-3-5-9(10)11(13)14;/h3-6,8H,7H2,1-2H3,(H,13,14);/q;+1/p-1
    • InChI Key: REWQYEQHPFDJHO-UHFFFAOYSA-M
    • SMILES: [Na+].O(C(C1C=CC=CC=1C(=O)[O-])=O)CC(C)C

Computed Properties

  • Exact Mass: 244.071154
  • Monoisotopic Mass: 244.071154
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 5
  • Complexity: 265
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 66.4

Experimental Properties

  • Boiling Point: 356.6°Cat760mmHg
  • Flash Point: 135°C
Recommended suppliers
TAIXING JOXIN BIO-TEC CO.,LTD.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
TAIXING JOXIN BIO-TEC CO.,LTD.
Jinta Yudi Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jinta Yudi Pharmaceutical Technology Co., Ltd.
Hangzhou TSurgeX Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Hangzhou TSurgeX Pharmaceutical Technology Co., Ltd.
上海嶸奧生物技術(shù)有限公司
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
上海嶸奧生物技術(shù)有限公司
煙臺朗裕新材料科技有限公司
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent