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(2S,4E)-2-Amino-5-boronopent-4-enoic acid

HCID 57416319
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
212839-33-3
Standard SMILES
N[C@@H](C/C=C/B(O)O)C(=O)O
InChIKey
OUJIGNMQBCCYRL-REJIZHKJSA-N
Molecular formula
C5H10BNO4
Average molar mass
158.95 g/mol
Monoisotopic mass
159.070288

Names & identifiers

Preferred name
(2S,4E)-2-Amino-5-boronopent-4-enoic acid
IUPAC
(E,2S)-2-amino-5-boronopent-4-enoic acid

Names & synonyms

212839-33-3(S,E)-2-Amino-5-boronopent-4-enoic acid(2S,4E)-2-Amino-5-boronopent-4-enoic acidDTXSID90725997

Database identifiers

CAS
212839-33-3
PubChem CID
57416319
DTXSID
DTXSID90725997
Nikkaji
J1.272.476D

Properties

Computed structural properties

Topological polar surface area
104 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
11
Formal charge
0
Complexity
159

Related reactions

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Compound notes

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