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6-butyl-2-[2-hydroxy-3-(2-phenylpropan-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenyl]-2H,5H,6H,7H-[1,2,3]triazolo[4,5-f]isoindole-5,7-dione

HCID 59348917
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Basic information

CAS
945857-19-2
Standard SMILES
CCCCN1C(=O)c2cc3nn(-c4cc(C(C)(C)CC(C)(C)C)cc(C(C)(C)c5ccccc5)c4O)nc3cc2C1=O
InChIKey
RTGXQEDCXOAARE-UHFFFAOYSA-N
Molecular formula
C35H42N4O3
Average molar mass
566.73 g/mol

Names & identifiers

Preferred name
6-butyl-2-[2-hydroxy-3-(2-phenylpropan-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenyl]-2H,5H,6H,7H-[1,2,3]triazolo[4,5-f]isoindole-5,7-dione
English name
6-butyl-2-[2-hydroxy-3-(2-phenylpropan-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenyl]-2H,5H,6H,7H-[1,2,3]triazolo[4,5-f]isoindole-5,7-dione
Molecular formula
C35H42N4O3
Molecular weight
566.73

Names & synonyms

6-Butyl-2-(2-hydroxy-3-(2-phenylpropan-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenyl)-[1,2,3]triazolo[4,5-f]isoindole-5,7(2H,6H)-dione6-Butyl-2-[2-hydroxy-3-(2-phenylpropan-2-yl)-5-(2,4,4-trimethyl pentan-2-yl)phenyl]pyrrolo[3,4-F]benzotriazole-5,7-dione6-Butyl-2-[2-hydroxy-3-(2-phenyl-2-propyl)-5-(2,4,4-trimethyl-2-pentyl)phenyl]-[1,2,3]triazolo[4,5-f]isoindole-5,7(2H,6H)-dionePyrrolo[3,4-f]benzotriazole-5,7(2H,6H)-dione, 6- butyl-2-[2-hydroxy-3-(1-methyl-1-phenylethyl)-5- (1,1,3,3-tetramethylbutyl)phenyl]-6-butyl-2-[2-hydroxy-3-(2-phenylpropan-2-yl)-5-(2,4,4-trimethylpentan-2-yl)phenyl]-2H,5H,6H,7H-[1,2,3]triazolo[4,5-f]isoindole-5,7-dione

Database identifiers

CAS
945857-19-2
PubChem CID
59348917
EC Number
810-065-4
Nikkaji
J3.002.297A

Properties

Physicochemical properties

Boiling point
669.6 · 669.6±65.0 °C(Predicted)
Density
1.16 · 1.16±0.1 g/cm3(Predicted)
pka
7.76 · 7.76±0.50(Predicted)
Hazard statements
413 · H413

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Hazard statements
H413

Chemistry & industry

Suppliers8 total

杭州品高化工有限公司0571-87658025 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
山东大有药物研发有限公司[email protected] 15165037910 · [email protected]
四川义研药物研究有限公司19949968070; 19949968070 · [email protected]
华诺医药科技(广西)有限公司13005928603 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
武汉睿立达生物医药科技有限公司18201884268 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +8619957148339 · [email protected]

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