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2-Amino-3,5-dibromo-N'-(4-tert-butylcyclohexylidene)benzohydrazide

HCID 3320180
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Basic information

CAS
303084-77-7
Standard SMILES
CC(C)(C)C1CCC(=NNC(=O)c2cc(Br)cc(Br)c2N)CC1
InChIKey
VATLMLNDTBVCDN-UHFFFAOYSA-N
Molecular formula
C17H23Br2N3O
Average molar mass
445.2 g/mol
Monoisotopic mass
443.02079

Names & identifiers

Preferred name
2-Amino-3,5-dibromo-N'-(4-tert-butylcyclohexylidene)benzohydrazide
IUPAC
2-amino-3,5-dibromo-N-[(4-tert-butylcyclohexylidene)amino]benzamide
English name
2-amino-3,5-dibromo-N'-(4-tert-butylcyclohexylidene)benzohydrazide
Molecular formula
C17H23Br2N3O
Molecular weight
445.19202

Names & synonyms

2-amino-3,5-dibromo-N'-(4-tert-butylcyclohexylidene)benzohydrazideRefChem:463593303084-77-7659-040-8AKOS024401076

Database identifiers

CAS
303084-77-7
PubChem CID
3320180
EC Number
659-040-8

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
67.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
23
Formal charge
0
Complexity
451

Physicochemical properties

Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
335 · H335-H413-H319-H315
Precautionary statements
264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362

Safety & regulation

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

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H335-H413-H319-H315
Precautionary statements
P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362

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Compound notes

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