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CAS Number: 81532-76-5
2-chloro-5,6,7,8-tetrahydroquinazoline

Structure

2-chloro-5,6,7,8-tetrahydroquinazoline
Name: 2-chloro-5,6,7,8-tetrahydroquinazoline
Synonyms:
General Information
Product Number: 81532765

CAS Registry Number 81532-76-5
Name:
Quinazoline, 2-​chloro-​5,​6,​7,​8-​tetrahydro-
2-Chloro-5,6,7,8-tetrahydroquinazoline

 

Chemical Formula: C8H9ClN2
Exact Mass: 168.05
Molecular Weight: 168.62
m/z: 168.05 (100.0%), 170.04 (32.0%), 169.05 (8.8%), 171.05 (2.8%)

 

InChI:InChI=1S/C8H9ClN2/c9-8-10-5-6-3-1-2-4-7(6)11-8/h5H,1-4H2

InChI Key:OWQMLYNISASSPM-UHFFFAOYSA-N

Canonical SMILES:C1CCC2=NC(=NC=C2C1)Cl

 

Thermal Properties Value Condition Note
Melting Point 34-36 °C   (1)IC
Melting Point 34-36 °C   (2)IC

Specification

98%

References
  1. (1) Sekiya, Tetsuo; European Journal of Medicinal Chemistry 1982, V17(1), P75-9 CAPLUS
  2. (2) Sekiya, Tetsuo; Chemical & Pharmaceutical Bulletin 1983, V31(7), P2254-61 CAPLUS
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