CAS
92050-16-3 Purity
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92050-16-3 Purity
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1-(2-Chloro-4-fluorophenyl)-cyclopropanamine
CAS
920501-75-3
Catalog Number
ACM920501753
Category
Other Products
Molecular Formula
C9H9ClFN
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Specification
Synonyms
Cyclopropanamine, 1-(2-chloro-4-fluorophenyl)-
What is the molecular formula of the compound?
The molecular formula is C9H9ClFN.
What is the IUPAC name of the compound?
The IUPAC name is 1-(2-chloro-4-fluorophenyl)cyclopropan-1-amine.
What is the InChI of the compound?
The InChI of the compound is InChI=1S/C9H9ClFN/c10-8-5-6(11)1-2-7(8)9(12)3-4-9/h1-2,5H,3-4,12H2.
What is the InChIKey of the compound?
The InChIKey is HSXYMWHMEKDUJU-UHFFFAOYSA-N.
What is the canonical SMILES of the compound?
The canonical SMILES is C1CC1(C2=C(C=C(C=C2)F)Cl)N.
What is the molecular weight of the compound?
The molecular weight is 185.62 g/mol.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 1.9.
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 2 hydrogen bond acceptor counts.
How many rotatable bond counts does the compound have?
The compound has 1 rotatable bond count.
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