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Home > Encyclopedia > Bicyclo[1.1.1]pentane-1-carboxylic acid, methyl ester (9CI)

Bicyclo[1.1.1]pentane-1-carboxylic acid, methyl ester (9CI)

Bicyclo[1.1.1]pentane-1-carboxylic acid, methyl ester (9CI) structure

Bicyclo[1.1.1]pentane-1-carboxylic acid, methyl ester (9CI) 

structure
  • CAS No:

    106813-54-1

  • Formula:

    C7H10O2

  • Chemical Name:

    Bicyclo[1.1.1]pentane-1-carboxylic acid, methyl ester (9CI)

  • Synonyms:

    methyl bicyclo[1.1.1]pentane-1-carboxylate;methyl bicyclo[1.1.1]pentane-3-carboxylate;SCHEMBL17586310;CTK8G5217;ZINC32302899;SB15397;methylbicyclo[1.1.1]pentane-1-carboxylate;Bicyclo[1.1.1]pentane-1-carboxylic acid methyl ester;bicyclo[1.1.1]pentane-1-carboxylic acid, methyl ester

Bicyclo[1.1.1]pentane-1-carboxylic acid, methyl ester (9CI) Basic Attributes

126.1531

126.068

Characteristics

26.3

0.8

1.235±0.06 g/cm3(Predicted)

152.3±8.0 °C(Predicted)

Computed Properties

Molecular Weight:126.15
XLogP3:0.8
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:126.068079557
Monoisotopic Mass:126.068079557
Topological Polar Surface Area:26.3
Heavy Atom Count:9
Complexity:145
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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