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8-Methylidene-5,6,7,8-tetrahydroquinoline

HCID 22018666
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
91900-43-5
Standard SMILES
C=C1CCCc2cccnc21
InChIKey
LFHOFRHETFNXQB-UHFFFAOYSA-N
Molecular formula
C10H11N
Average molar mass
145.2 g/mol
Monoisotopic mass
145.08914936

Names & identifiers

Preferred name
8-Methylidene-5,6,7,8-tetrahydroquinoline
IUPAC
8-methylidene-6,7-dihydro-5H-quinoline

Names & synonyms

91900-43-58-methylidene-5,6,7,8-tetrahydroquinolineRefChem:548291993-870-48-Methylene-5,6,7,8-tetrahydroquinoline8-methylidene-6,7-dihydro-5H-quinolineSCHEMBL4069326SCHEMBL13240630RDA90043EN300-768769

Database identifiers

CAS
91900-43-5
PubChem CID
22018666
EC Number
993-870-4

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
12.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
11
Formal charge
0
Complexity
162

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]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, 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%)

Related reactions

1 records
New reaction record
HRID 670714 reaction equation
HRID 670714As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)

Compound notes

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