tert-Butyl 2-bromo-5,6,8,9-tetrahydro-7H-imidazo[1,2-d][1,4]diazepine-7-carboxylate

Name: tert-Butyl 2-bromo-5,6,8,9-tetrahydro-7H-imidazo[1,2-d][1,4]diazepine-7-carboxylate
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CAS No. 1251020-42-4
Cat. No. CS-0145534
Molecule weight316.19
Purity≥95%
MDL No.MFCD18792837

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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
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tert-Butyl 2-bromo-5,6,8,9-tetrahydro-7H-imidazo[1,2-d][1,4]diazepine-7-carboxylate|CS-0145534

Structure of 1251020-42-4

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General Information

CAS No. 1251020-42-4
Cat. No. CS-0145534
Purity ≥95%
MDL No. MFCD18792837
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₂H₁₈BrN₃O₂
Molecular Weight 316.19
Synonym(s) 2-Bromo-5,6,8,9-tetrahydro-imidazo[1,2-a][1,4]diazepine-7-carboxylic acid tert-butyl ester
SMILES O=C(N1CCN2C(CC1)=NC(Br)=C2)OC(C)(C)C

Safety Information

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GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

TPSA 47.36
LogP 2.4388
H_Acceptors 4
H_Donors 0
Rotatable_Bonds 0

Other Classifications

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic heterocycle compounds Imidazole compounds

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tert-Butyl 2-bromo-5,6,8,9-tetrahydro-7H-imidazo[1,2-d][1,4]diazepine-7-carboxylate

CAS No. 1251020-42-4

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