CAS
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1-(3-Fluoro-phenyl)-n1,n1-dimethyl-ethane-1,2-diamine
Catalog Number
ACMA00000958
Category
Amines
Molecular Weight
182.24
Molecular Formula
C11H12N2O3S
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Specification
Hazard Statements
H318
RIDADR
UN 2811 6.1 / PGIII
Symbol
GHS05
What is the molecular formula of the compound?
The molecular formula is C10H15FN2.
What is the molecular weight of the compound?
The molecular weight is 182.24 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is 1-(3-fluorophenyl)-N,N-dimethylethane-1,2-diamine.
What are the synonyms of the compound?
The synonyms are 855715-28-5, 1-(3-Fluoro-phenyl)-N1,N1-dimethyl-ethane-1,2-diamine, 1-(3-fluorophenyl)-N,N-dimethylethane-1,2-diamine, [2-amino-1-(3-fluorophenyl)ethyl]dimethylamine.
What is the InChI code of the compound?
The InChI code is InChI=1S/C10H15FN2/c1-13(2)10(7-12)8-4-3-5-9(11)6-8/h3-6,10H,7,12H2,1-2H3.
What is the InChIKey of the compound?
The InChIKey is JDBOOJQLAVTZQE-UHFFFAOYSA-N.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 1.
How many hydrogen bond donor counts does the compound have?
The compound has 1 hydrogen bond donor count.
How many hydrogen bond acceptor counts does the compound have?
The compound has 3 hydrogen bond acceptor counts.
How many rotatable bond counts does the compound have?
The compound has 3 rotatable bond counts.
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