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DIMETHYLA-BROMOGLUTARATE

DIMETHYLA-BROMOGLUTARATE structure

CAS No:
760-94-1
Formula:
C7H11BrO4
Chemical Name:
DIMETHYLA-BROMOGLUTARATE
Synonyms:
NISTC760941;DIMETHYL A-BROMOGLUTARATE;Dimethyl 2-bromoglutarate;Dimethyl alpha-bromoglutarate;dimethyl 2-bromopentanedioate;2-bromoglutaric acid dimethyl ester
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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DIMETHYLA-BROMOGLUTARATE Basic Attributes

Molecular Weight：

239.06

Exact Mass：

237.98400

HScode：

2917190090

Characteristics

PSA：

52.6

XLogP3：

1.1

Density：

1.452g/cm3

Boiling Point：

135℃ (11 Torr)

Flash Point：

99.1±23.2℃

Refractive Index：

1.467

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:239.06
XLogP3:1.1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:237.98407
Monoisotopic Mass:237.98407
Topological Polar Surface Area:52.6
Heavy Atom Count:12
Complexity:169
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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