CAS
926257-20-7 Purity
96%
926257-20-7 Purity
96%
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N-(5-Amino-2-fluorophenyl)-2-methylpropanamide
CAS
926259-44-1
Catalog Number
ACM926259441
Category
Other Products
Molecular Weight
196.221423 [g/mol]
Molecular Formula
C10H13FN2O
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Specification
Synonyms
N-(5-amino-2-fluorophenyl)-2-methylpropanamide, STK497933, 926259-44-1, AGN-PC-015TUR, CTK5H1520, MolPort-004-294-297, ZINC19093161, AKOS000100041, AG-H-79425, MCULE-1129521605, N-(5-Amino-2-fluorophenyl)isobutyramide, AK121263, BB 0217130
IUPAC Name
N-(5-amino-2-fluorophenyl)-2-methylpropanamide
Canonical SMILES
CC(C)C(=O)NC1=C(C=CC(=C1)N)F
InChI Key
HVYCJIRHRUICEK-UHFFFAOYSA-N
Boiling Point
379.852ºC at 760 mmHg
Flash Point
183.528ºC
Density
1.208g/cm³
Exact Mass
196.10100
H-Bond Acceptor
3
H-Bond Donor
2
What is the molecular formula of the compound N-(5-Amino-2-fluorophenyl)-2-methylpropanamide?
The molecular formula is C10H13FN2O.
When was the compound created and modified according to PubChem?
It was created on November 13, 2007, and modified on December 30, 2023.
What is the IUPAC name of the compound?
The IUPAC name is N-(5-amino-2-fluorophenyl)-2-methylpropanamide.
What is the InChI of the compound?
The InChI is InChI=1S/C10H13FN2O/c1-6(2)10(14)13-9-5-7(12)3-4-8(9)11/h3-6H,12H2,1-2H3,(H,13,14).
Can you provide the Canonical SMILES of the compound?
The Canonical SMILES is CC(C)C(=O)NC1=C(C=CC(=C1)N)F.
What is the molecular weight of N-(5-Amino-2-fluorophenyl)-2-methylpropanamide?
The molecular weight is 196.22 g/mol.
How many hydrogen bond donor counts does the compound have?
It has 2 hydrogen bond donor counts.
What is the topological polar surface area of the compound?
The topological polar surface area is 55.1 Ų.
Does the compound have any defined atom stereocenter count?
No, it does not have any defined atom stereocenter count.
Is the compound canonicalized in PubChem?
Yes, the compound is canonicalized in PubChem.
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