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2-Cyanobutanedioicacid,dimethylester

2-Cyanobutanedioicacid,dimethylester structure

CAS No:
6283-71-2
Formula:
C7H9NO4
Chemical Name:
2-Cyanobutanedioicacid,dimethylester
Synonyms:
dimethyl 2-cyanosuccinate;2-Cyanosuccinic acid dimethyl ester;Dimethyl cyanosuccinate;Butanedioic acid, cyano-, dimethyl ester;1,4-dimethyl 2-cyanobutanedioate;2-Cyanobutanedioicacid,dimethylester;2-Cyanobutanedioic acid dimethyl ester;BRN 1781500;AI3-11155;Succinic acid, cyano-, dimethyl ester

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2-Cyanobutanedioicacid,dimethylester Basic Attributes

Molecular Weight：

171.15

Exact Mass：

171.053162

NSC Number：

7708

HScode：

2926909090

Characteristics

PSA：

76.4

XLogP3：

-0.1

Density：

1.2±0.1 g/cm3

Boiling Point：

287.9°C at 760 mmHg

Flash Point：

124.1±13.4 °C

Refractive Index：

1.437

Computed Properties

Molecular Weight:171.15
XLogP3:-0.1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:171.05315777
Monoisotopic Mass:171.05315777
Topological Polar Surface Area:76.4
Heavy Atom Count:12
Complexity:227
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-Cyanobutanedioicacid,dimethylester

Basic Attributes
Characteristics
Computed Properties

2-Cyanobutanedioicacid,dimethylester

SDS

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