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3-Amino-3-phosphonobutanoic acid

HCID 52689
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Basic information

CAS
73870-70-9
Standard SMILES
CC(N)(CC(=O)O)P(=O)(O)O
InChIKey
FCZSLDKFCPPVAD-UHFFFAOYSA-N
Molecular formula
C4H10NO5P
Average molar mass
183.1 g/mol
Monoisotopic mass
183.02965942

Names & identifiers

Preferred name
3-Amino-3-phosphonobutanoic acid
IUPAC
3-amino-3-phosphonobutanoic acid

Names & synonyms

3-amino-3-phosphonobutanoic acid73870-70-9DTXSID50995018RefChem:1067306DTXCID3014220483-Amino-3-phosphonobutyric acidBRN 2092730BUTYRIC ACID, 3-AMINO-3-PHOSPHONO-SCHEMBL9308664

Database identifiers

CAS
73870-70-9
PubChem CID
52689
DTXSID
DTXSID50995018
Nikkaji
J1.304.067B

Properties

Computed structural properties

XLogP
-5
Topological polar surface area
121 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
11
Formal charge
0
Complexity
211

Related reactions

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Compound notes

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