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Iproclozide

HCID 19063
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
3544-35-2
Standard SMILES
CC(C)NNC(=O)COc1ccc(Cl)cc1
InChIKey
GGECDTUJZOXAAR-UHFFFAOYSA-N
Molecular formula
C11H15ClN2O2
Average molar mass
242.7 g/mol
Monoisotopic mass
242.0822054

Overview

Iproclozide is an aromatic ether.

Names & identifiers

Preferred name
Iproclozide
IUPAC
2-(4-chlorophenoxy)-N'-propan-2-ylacetohydrazide
English name
iproclozide
Molecular formula
C11H15ClN2O2
Molecular weight
242.7

Names & synonyms

Iproclozide3544-35-2IproclozidaIproclozidumIproclozide [INN:BAN:DCF]PC-6031II9D6CB3J2-(4-chlorophenoxy)-N'-(propan-2-yl)acetohydrazideDTXSID70188925(4-Chlorophenoxy)acetic acid 2-(1-methylethyl)hydrazideIproclozide (INN:BAN:DCF)RefChem:148658
Show more names
SOG-4lproclozide2-(4-CHLOROPHENOXY)-N'-ISOPROPYLACETOHYDRAZIDE2-(4-chlorophenoxy)-N'-isopropyl-acetohydrazide2-(4-chlorophenoxy)-N'-propan-2-yl-ethanehydrazide
DTXCID30111416N06AF06p-(chlorophenoxy)acetic acid 2-isopropylhydrazide222-589-5Iproclozid2-(4-chlorophenoxy)-N'-propan-2-ylacetohydrazideSinderesinSursum

Database identifiers

CAS
3544-35-2
PubChem CID
19063
DTXSID
DTXSID70188925
ChEMBL
CHEMBL91238
ChEBI
CHEBI:134988

Properties

Computed structural properties

XLogP
2
Topological polar surface area
50.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
16
Formal charge
0
Complexity
216

Experimental & physicochemical properties

DrugsPharmaceuticals -> Listed in ZINC15
LogP2.01

Physicochemical properties

Melting point
93 · 93-94°
Boiling point
280 °C · 280°C (rough estimate)
Density
1.2691 · 1.2691 (rough estimate)
refractive index
1.527 · 1.5270 (estimate)
FDA UNII
1 II9D6CB3J · 1II9D6CB3J
ATC code
6 AF06 · N06AF06
RIDADR
3249 · 3249
HazardClass
6.1 · 6.1(b)
PackingGroup
III

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

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

ridadr
3249
hazard_class
6.1(b)
packing_group
III

Chemistry & industry

Pharmacology

ATC Code · 2 items

N - Nervous system

QN - Nervous system

Upstream & downstream products

Upstream raw materials

Acetic acid, 2-(4-chlorophenoxy)-, 2-(1-methylethylidene)hydrazide

Suppliers6 total

山东利腾生物科技有限公司+86-18663721413 +86-15552573001 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
成都标样生物科技有限公司028-81700200 13308200041 · [email protected]
TargetMol中国(陶术生物)4008200310 15002144251 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
山东碳氢生物化工有限公司13060081947 13060081947 · [email protected]

Additional notes

DefinitionChEBI: Iproclozide is an aromatic ether.

Related reactions

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
UNII
1II9D6CB3J
EC Number
222-589-5
Nikkaji
J7.961H