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CAS Number: 101094-85-3
1-chloro-4-(pyridin-4-ylmethyl)phthalazine

Structure

 1-chloro-4-(pyridin-4-ylmethyl)phthalazine
Name: 1-chloro-4-(pyridin-4-ylmethyl)phthalazine
Synonyms:
General Information
Product Number: 101094853

CAS Registry Number 101094-85-3
Name:
Phthalazine, 1-?chloro-?4-?(4-?pyridinylmethyl)?-
Phthalazine, 1-chloro-4-(4-pyridylmethyl)- (6CI)
1-Chloro-4-(4-pyridinylmethyl)phthalazine
1-Chloro-4-[(4-pyridyl)methyl]phthalazine

 

Chemical Formula: C14H10ClN3
Exact Mass: 255.06
Molecular Weight: 255.70
m/z: 255.06 (100.0%), 257.05 (32.0%), 256.06 (15.3%), 258.06 (4.9%), 257.06 (1.2%), 256.05 (1.1%)

 

InChI:InChI=1S/C14H10ClN3/c15-14-12-4-2-1-3-11(12)13(17-18-14)9-10-5-7-16-8-6-10/h1-8H,9H2

InChI Key:LVSFOJFCLFTXTO-UHFFFAOYSA-N

Canonical SMILES:C1=CC=C2C(=C1)C(=NN=C2Cl)CC3=CC=NC=C3

 

Thermal Properties Value Condition Note
Melting Point 180-181 °C   (1)CAS
Melting Point 170 °C Solv: ethanol (64-17-5) (2)CAS

Specification

98%
References
  1. (1) Zhang, Shulan; European Journal of Medicinal Chemistry 2010, V45(8), P3504-3510 CAPLUS
  2. (2) Druey, Jean; US 2960504 1960 CAPLUS
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