N-(tert-butoxycarbonyl)-2-hydroxymethyl-4,5-dihydropyrrole

HCID 57734312
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Basic information

Standard SMILES
CC(C)(C)OC(=O)N1CCC=C1CO
InChIKey
MBYYHZUQGMDOSQ-UHFFFAOYSA-N
Molecular formula
C10H17NO3
Average molar mass
199.25 g/mol
Monoisotopic mass
199.1208434

Names & identifiers

Preferred name
N-(tert-butoxycarbonyl)-2-hydroxymethyl-4,5-dihydropyrrole
IUPAC
tert-butyl 5-(hydroxymethyl)-2,3-dihydropyrrole-1-carboxylate

Names & synonyms

851857-14-2tert-butyl 5-(hydroxymethyl)-2,3-dihydropyrrole-1-carboxylateSCHEMBL2070705MBYYHZUQGMDOSQ-UHFFFAOYSA-Ntert-butyl 5-(hydroxymethyl)-2,3-dihydro-1H-pyrrole-1-carboxylateN-(tert-butoxycarbonyl)-2-hydroxymethyl-4,5-dihydropyrrole

Database identifiers

PubChem CID
57734312

Properties

Computed structural properties

XLogP
0.7
Topological polar surface area
49.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
14

Related reactions

2 records
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Compound notes

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