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CAS Number: 31250-80-3
1-benzyl-2,4,5-tribromo-1H-imidazole

Structure

1-benzyl-2,4,5-tribromo-1H-imidazole
Name: 1-benzyl-2,4,5-tribromo-1H-imidazole
Synonyms:
General Information
Product Number: 31250803

CAS Registry Number 31250-80-3
Name:
1H-?Imidazole, 2,?4,?5-?tribromo-?1-?(phenylmethyl)?-
Imidazole, 1-benzyl-2,4,5-tribromo- (8CI)
2,4,5-Tribromo-1-(phenylmethyl)-1H-imidazole
1-Benzyl-2,4,5-tribromoimidazole

 

Chemical Formula: C10H7Br3N2
Exact Mass: 391.82
Molecular Weight: 394.89
m/z: 393.81 (100.0%), 395.81 (97.4%), 391.82 (34.3%), 397.81 (31.6%), 394.82 (10.9%), 396.82 (10.6%), 392.82 (3.7%), 398.81 (3.6%)

 

InChI:InChI=1S/C10H7Br3N2/c11-8-9(12)15(10(13)14-8)6-7-4-2-1-3-5-7/h1-5H,6H2

InChI Key:DPVXZXBHQWNJDP-UHFFFAOYSA-N

Canonical SMILES:C1=CC=C(C=C1)CN2C(=C(N=C2Br)Br)Br

 

Thermal Properties Value Condition Note
Melting Point 58-59 °C Solv: ethanol (64-17-5) (1)IC

Specification

98%

References
  1. (1) Iddon, Brian; Journal of the Chemical Society, Chemical Communications 1985, (20), P1428-9 CAPLUS
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