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1,3-Dimethyl 2-bromopropanedioate

1,3-Dimethyl 2-bromopropanedioate structure

CAS No:
868-26-8
Formula:
C5H7BrO4
Chemical Name:
1,3-Dimethyl 2-bromopropanedioate
Synonyms:
Propanedioic acid,2-bromo-,1,3-dimethyl ester;Malonic acid,bromo-,dimethyl ester;Propanedioic acid,bromo-,dimethyl ester;1,3-Dimethyl 2-bromopropanedioate;Dimethyl bromomalonate;Dimethyl α-bromomalonate;Dimethyl 2-bromopropanedioate;NSC 175888;Dimethyl 2-bromomalonate

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Description

clear colorless to light yellow liquid

1,3-Dimethyl 2-bromopropanedioate Basic Attributes

Molecular Weight：

211.01

Exact Mass：

211.01

EC Number：

212-775-4

UNII：

D2V5M6E7E6

NSC Number：

175888

DSSTox ID：

DTXSID60235811

HScode：

2917190090

Characteristics

PSA：

52.6

XLogP3：

0.92

Appearance：

Clear colorless to light yellow Liquid

Density：

1.6094 g/cm³ @ Temp: 20 °C

Boiling Point：

103-104 °C @ Press: 19 Torr

Flash Point：

>230 °F

Refractive Index：

1.466

Safety Information

Packing level：

III

Hazard category：

Transport codes：

UN 3265 8/PG 2

wgk germany：

hazard class code：

34-37

safety instructions：

26-36/37/39-45

Marks：

Precautionary statement(s)：

P280-P305 + P351 + P338-P310

Hazard Statements：

H314

GHS Classification：

|Danger|H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501|Aggregated GHS information provided by 40 companies from 3 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:211.01
XLogP3:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:209.95277
Monoisotopic Mass:209.95277
Topological Polar Surface Area:52.6
Heavy Atom Count:10
Complexity:129
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,3-Dimethyl 2-bromopropanedioate

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties
Learn More Other Chemicals

1,3-Dimethyl 2-bromopropanedioate

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