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CAS Number: 37663-46-0
3H-spiro[isobenzofuran-1,4'-piperidin]-3-one

Structure

3H-spiro[isobenzofuran-1,4'-piperidin]-3-one
Name: 3H-spiro[isobenzofuran-1,4'-piperidin]-3-one
Synonyms:
General Information
Product Number: 37663460

CAS Registry Number: 37663-46-0

Name:

Spiro[isobenzofuran-​1(3H)​,​4'-​piperidin]​-​3-​one
3-​Oxospiro[isobenzofur​an-​1(3H)​,​4'-​piperidine]; 3H-​Spiro[2-​benzofuran-​1,​4'-​piperidine]​-​3-​one; Spiro[phthalan-​1,​4'-​piperidin]​-​3-​one 

 

Chemical Formula: C12H13NO2
Exact Mass: 203.09
Molecular Weight: 203.24
m/z: 203.09 (100.0%), 204.10 (13.2%), 205.10 (1.3%)

 

InChI: InChI=1S/C12H13NO2/c14-11-9-3-1-2-4-10(9)12(15-11)5-7-13-8-6-12/h1-4,13H,5-8H2
InChIKey: RNMPNVBLQHYANU-UHFFFAOYSA-N
Canonical SMILES : C1CNCCC12C3=CC=CC=C3C(=O)O2

 

Thermal Properties Value Condition Note
Melting Point 132-133 °C   (1)IC
Melting Point 124-127 °C   (2)IC

Specification

98%

References
  1. (1) Parham, William E.; Journal of Organic Chemistry 1976, V41(15), P2628-33 CAPLUS
  2. (2) Marxer, Adrian; Journal of Organic Chemistry 1975, V40(10), P1427-33 CAPLUS
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