CAS
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6-Chloro-2-fluoro-3-methylbenzylamine
Catalog Number
ACMA00001877
Category
Aryl Fluorinated Building Blocks
Molecular Weight
173.62
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Specification
Hazard Statements
H302
RIDADR
NONH for all modes of transport
Symbol
GHS07
What is the molecular formula of 6-Chloro-2-fluoro-3-methylbenzylamine?
The molecular formula is C8H9ClFN.
When was 6-Chloro-2-fluoro-3-methylbenzylamine created and last modified?
It was created on 2005-07-19 and last modified on 2023-12-23.
What is the IUPAC name of 6-Chloro-2-fluoro-3-methylbenzylamine?
The IUPAC name is (6-chloro-2-fluoro-3-methylphenyl)methanamine.
What is the InChI of 6-Chloro-2-fluoro-3-methylbenzylamine?
The InChI is InChI=1S/C8H9ClFN/c1-5-2-3-7(9)6(4-11)8(5)10/h2-3H,4,11H2,1H3.
What is the InChIKey of 6-Chloro-2-fluoro-3-methylbenzylamine?
The InChIKey is DVMQLADOLJGLSY-UHFFFAOYSA-N.
What is the canonical SMILES of 6-Chloro-2-fluoro-3-methylbenzylamine?
The canonical SMILES is CC1=C(C(=C(C=C1)Cl)CN)F.
What is the molecular weight of 6-Chloro-2-fluoro-3-methylbenzylamine?
The molecular weight is 173.61 g/mol.
How many hydrogen bond donor counts does 6-Chloro-2-fluoro-3-methylbenzylamine have?
It has 1 hydrogen bond donor count.
What is the topological polar surface area of 6-Chloro-2-fluoro-3-methylbenzylamine?
The topological polar surface area is 26?2.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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