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8-Quinolyl N-(M-tolyl)carbamate

HCID 3307286
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Basic information

CAS
99541-01-2
Standard SMILES
Cc1cccc(NC(=O)Oc2cccc3cccnc23)c1
InChIKey
IVNXRBAXEBOJEW-UHFFFAOYSA-N
Molecular formula
C17H14N2O2
Average molar mass
278.3 g/mol
Monoisotopic mass
278.10552769

Names & identifiers

Preferred name
8-Quinolyl N-(M-tolyl)carbamate
IUPAC
quinolin-8-yl N-(3-methylphenyl)carbamate

Names & synonyms

99541-01-28-quinolyl n-(m-tolyl)carbamateRefChem:548444665-641-6Quinolin-8-yl m-tolylcarbamateCHEMBL1603128-quinolinyl 3-methylphenylcarbamateAKOS024334513

Database identifiers

CAS
99541-01-2
PubChem CID
3307286
ChEMBL
CHEMBL160312
EC Number
665-641-6

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
51.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
21
Formal charge
0
Complexity
361

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

Danger

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

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+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%)

Related reactions

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Compound notes

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