CID 21761174
PubChem CID
21761174
Structure
Molecular Formula
Status
Non-live
Molecular Weight
138.50 g/mol
Dates
- Create:2007-12-05
Chemical Structure Depiction
propanedioate;hydrochloride
InChI=1S/C3H4O4.ClH/c4-2(5)1-3(6)7;/h1H2,(H,4,5)(H,6,7);1H/p-2
SNBDGFZQPKCZTO-UHFFFAOYSA-L
C(C(=O)[O-])C(=O)[O-].Cl
C3H3ClO4-2
Property Name
Property Value
Reference
Property Name
Molecular Weight
Property Value
138.50 g/mol
Property Name
Hydrogen Bond Donor Count
Property Value
1
Property Name
Hydrogen Bond Acceptor Count
Property Value
4
Property Name
Rotatable Bond Count
Property Value
0
Property Name
Exact Mass
Property Value
137.9719863 g/mol
Property Name
Monoisotopic Mass
Property Value
137.9719863 g/mol
Property Name
Topological Polar Surface Area
Property Value
80.3A^2
Property Name
Heavy Atom Count
Property Value
8
Property Name
Formal Charge
Property Value
-2
Property Name
Complexity
Property Value
72.1
Property Name
Isotope Atom Count
Property Value
0
Property Name
Defined Atom Stereocenter Count
Property Value
0
Property Name
Undefined Atom Stereocenter Count
Property Value
0
Property Name
Defined Bond Stereocenter Count
Property Value
0
Property Name
Undefined Bond Stereocenter Count
Property Value
0
Property Name
Covalently-Bonded Unit Count
Property Value
2
Property Name
Compound Is Canonicalized
Property Value
Yes
Old substance
CONTENTS