2-Benzyloxycarbonylamino-5,5-dimethyl-hex-2-enoic acid methyl ester

HCID 69433708
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
COC(=O)C(=CCC(C)(C)C)NC(=O)OCc1ccccc1
InChIKey
CLTYKEQQRFBTLE-UHFFFAOYSA-N
Molecular formula
C17H23NO4
Average molar mass
305.4 g/mol

Names & identifiers

Preferred name
2-Benzyloxycarbonylamino-5,5-dimethyl-hex-2-enoic acid methyl ester
IUPAC
methyl 5,5-dimethyl-2-(phenylmethoxycarbonylamino)hex-2-enoate

Names & synonyms

SCHEMBL5416980CLTYKEQQRFBTLE-UHFFFAOYSA-N2-benzyloxycarbonylamino-5,5-dimethyl-hex-2-enoic acid methyl ester

Database identifiers

PubChem CID
69433708

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
64.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
8
Heavy atoms
22

Related reactions

5 records
New reaction record

Compound notes

Loading…