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(S)-3-Azido-2-methylpropanoic acid, methyl ester

HCID 154015
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
107747-84-2
Standard SMILES
COC(=O)[C@@H](C)CN=[N+]=[N-]
InChIKey
AWKLAGQCWMZXOZ-BYPYZUCNSA-N
Molecular formula
C5H9N3O2
Average molar mass
143.14 g/mol
Monoisotopic mass
143.06947654

Names & identifiers

Preferred name
(S)-3-Azido-2-methylpropanoic acid, methyl ester
IUPAC
methyl (2S)-3-azido-2-methylpropanoate

Names & synonyms

107747-84-2(S)-3-Azido-2-methylpropanoic acid, methyl esterMethyl (S)-3-Azido-2-methylpropanoateCCRIS 8042(S)-Methyl-2-azidomethylpropionatemethyl (2S)-3-azido-2-methylpropanoateSCHEMBL14123552DTXSID60910510AWKLAGQCWMZXOZ-BYPYZUCNSA-Nmethyl 3-azido-2-methylpropanoate(s)-3-azido-2-methyl-propionic acid methyl ester

Database identifiers

CAS
107747-84-2
PubChem CID
154015
DTXSID
DTXSID60910510

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
40.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
10
Formal charge
0
Complexity
162

Related reactions

1 records
New reaction record
HRID 1360161 reaction equation
HRID 1360161As productuspto-grants-2011_02

Compound notes

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