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Merck
CN

349674

Dimethyl cis-1,2,3,6-tetrahydrophthalate

99%

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About This Item

Empirical Formula (Hill Notation):
C10H14O4
CAS Number:
Molecular Weight:
198.22
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
99%
Form:
liquid
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InChI

1S/C10H14O4/c1-13-9(11)7-5-3-4-6-8(7)10(12)14-2/h3-4,7-8H,5-6H2,1-2H3/t7-,8+

SMILES string

COC(=O)[C@H]1CC=CC[C@H]1C(=O)OC

InChI key

DVVAGRMJGUQHLI-OCAPTIKFSA-N

assay

99%

form

liquid

refractive index

n20/D 1.472 (lit.)

bp

141-142 °C/20 mmHg (lit.)

density

1.145 g/mL at 25 °C (lit.)

functional group

ester

Quality Level

General description

Epoxidation of dimethyl cis-1,2,3,6-tetrahydrophthalate has been reported. Desymmetrization of dimethyl cis-1,2,3,6-tetrahydrophthalate to (1S,2R)-1-methyl-cis-1,2,3,6-tetra-hydrophthalate has been reported.

Application

Dimethyl cis-1,2,3,6-tetrahydrophthalate may be used in chemical synthesis.

Storage Class

10 - Combustible liquids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves

Regulatory Information

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Stereospecific epoxidation of dihydrophthalates.
Cerefice SA and Fields EK.
The Journal of Organic Chemistry, 41(2), 355-361 (1976)
The use of enzymes in organic synthesis and the life sciences: perspectives from the Swiss Industrial Biocatalysis Consortium (SIBC).
Meyer H-P, et al.
Catalysis Science & Technology, 3(1), 29-40 (2013)

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