Products
  • Products
  • Buy offers
  • Encyclopedia
  • Msds lib
  • Synthesis
  • Reach Info
  • Suppliers
Home> Hot Product Listed 1   > 1,2-Benzenedicarboxylicacid, 1-isodecyl 2-octyl ester
20859-02-3 structure

1,2-Benzenedicarboxylicacid, 1-isodecyl 2-octyl ester

Iupac Name:(2S)-2-amino-3,3-dimethylbutanoic acid
CAS No.:20859-02-3
Molecular Weight:131.175
Molecular Formula:C10H9F3O2 (isomer)
Names and Identifiers
Synonyms

1,2-Benzenedicarboxylicacid, isodecyl octyl ester (9CI) 1-O-(8-methylnonyl) 2-O-octyl benzene-1,2-dicarboxylate 2-o-(8-methylnonyl) 1-o-octyl benzene-1,2-dicarboxylate AC1L24RR benzene-1,2-dicarboxylic acid O1-(8-methylnonyl) ester O2-octyl ester Dinopol IDO DTXSID9061675 hsdb 5814 Isodecyl alcohol, octyl phthalate (8CI) isodecyl octyl phthalate O1-(8-methylnonyl) O2-octyl benzene-1,2-dicarboxylate octyl isodecyl phthalate odp phthalic acid 1-(8-methylnonyl)2-octyl ester phthalic acid, isodecyl octyl ester Phthalic acid, isodecyl octyl ester (8CI) PX 118 UXLBXTIBYMXRNX-UHFFFAOYSA-N

Inchi
InChI=1S/C6H13NO2/c1-6(2,3)4(7)5(8)9/h4H,7H2,1-3H3,(H,8,9)/t4-/m1/s1
InChkey
NPDBDJFLKKQMCM-SCSAIBSYSA-N
Canonical Smiles
CC(C)(C)C(C(=O)O)N
Properties
Melting Point
300℃
Vapour
0.0499mmHg at 25°C
Refractive Index
-9 ° (C=3, H2O)
Flash Point
°C
Alpha
6.3 o (C=4, 6 N HCL 200 oC)
Solubility
In water, 2.0X10-5 mg/L at 25 deg C (est)
Safety and Handling
Safety Statements
S22;S24/25
Other Preventative Measures
SRP: Contaminated protective clothing should be segregated in such a manner so that there is no direct personal contact by personnel who handle, dispose, or clean the clothing. Quality assurance to ascertain the completeness of the cleaning procedures should be implemented before the decontaminated protective clothing is returned for reuse by the workers. Contaminated clothing should not be taken home at end of shift, but should remain at employee's place of work for cleaning.
Octanol/Water Partition Coefficient
log Kow = 9.45 (est)
Disposal Methods
SRP: The most favorable course of action is to use an alternative chemical product with less inherent propensity for occupational exposure or environmental contamination. Recycle any unused portion of the material for its approved use or return it to the manufacturer or supplier. Ultimate disposal of the chemical must consider: the material's impact on air quality; potential migration in soil or water; effects on animal, aquatic, and plant life; and conformance with environmental and public health regulations.
Reach Info
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s) no data available
Signal word

no data available

Hazard statement(s)

no data available

Precautionary statement(s)
Prevention

no data available

Response

no data available

Storage

no data available

Disposal

no data available

2.3 Other hazards which do not result in classification

no data available

Computational chemical data
  • Molecular Weight:131.175g/mol
  • Molecular Formula:C10H9F3O2
  • Compound Is Canonicalized:True
  • XLogP3-AA:_1.8
  • Exact Mass:131.095
  • Monoisotopic Mass:131.095
  • Complexity:115
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:63.3A^2
  • Heavy Atom Count:9
  • Defined Atom Stereocenter Count:1
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADccBiMAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAHgAQCAAADijBgAQCCABAAgAI AACQCAAAAAAAAAAAAIGAAAACABAAAAAAQAAEAAAAAAAAAAAJAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
Recommended Suppliers
  • Tel:86-21-33758180
  • Fax:86-21-51685790
  • Tel:86-571-88938639
  • Fax:86-571-88938652
  • Tel:86-571-85829152
  • Fax:86-571-85829153
  • Tel:+86-0592-5567629
  • Fax:+86-0592-5567629
  • Tel:86-371-86658258
  • Fax:86-371-86658258
  • Tel:86-571-87758773
  • Fax:86-571-86821328
  • Tel:86-25-83697070
  • Fax:86-25-83453275
  • Tel:86-571-87396430
  • Fax:86-571-87396431
  • Tel:86-576-88221016
  • Fax:86-576-88811295
  • Tel:86-27-83214668
  • Fax:86-27-83214668
Recommended Suppliers
  • Tel:86-21-33758180
  • Fax:86-21-51685790
  • Tel:86-571-88938639
  • Fax:86-571-88938652
  • Tel:86-571-85829152
  • Fax:86-571-85829153
  • Tel:+86-0592-5567629
  • Fax:+86-0592-5567629
  • Tel:86-371-86658258
  • Fax:86-371-86658258
  • Tel:86-571-87758773
  • Fax:86-571-86821328
  • Tel:86-25-83697070
  • Fax:86-25-83453275
  • Tel:86-571-87396430
  • Fax:86-571-87396431
  • Tel:86-576-88221016
  • Fax:86-576-88811295
  • Tel:86-27-83214668
  • Fax:86-27-83214668
 
<