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Prop-2-enoic acid--ethyl prop-2-enoate--ammonia (1/1/1)

HCID 175221
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Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
72863-11-7
Standard SMILES
C=CC(=O)O.C=CC(=O)OCC.N
InChIKey
VNUDNQYYVXMVJL-UHFFFAOYSA-N
Molecular formula
C8H15NO4
Average molar mass
189.21 g/mol
Monoisotopic mass
189.10010796

Names & identifiers

Preferred name
Prop-2-enoic acid--ethyl prop-2-enoate--ammonia (1/1/1)
IUPAC
azane;ethyl prop-2-enoate;prop-2-enoic acid
English name
2-Propenoic acid, polymer with ethyl 2-propenoate, ammonium salt
Molecular formula
C8H12O4
Molecular weight
172.18

Names & synonyms

DTXSID40993649Prop-2-enoic acid--ethyl prop-2-enoate--ammonia (1/1/1)2-Propenoic acid, polymer with ethyl 2-propenoate, ammonium salt

Database identifiers

CAS
72863-11-7
PubChem CID
175221
DTXSID
DTXSID40993649

Properties

Computed structural properties

Topological polar surface area
64.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
13
Formal charge
0
Complexity
132

Physicochemical properties

EPA Substance Registry System
2 · 2-Propenoic acid, polymer with ethyl 2-propenoate, ammonium salt (72863-11-7)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

tsca
TSCA listed

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes