3-amino-1,1,1-trifluorobutan-2-one hydrochloride

3-amino-1,1,1-trifluorobutan-2-one hydrochloride

CAS: 191981-64-3

Formula: C4H7ClF3NO

SMILES: Cl.CC(N)C(=O)C(F)(F)F

IUPAC: 3-amino-1,1,1-trifluorobutan-2-one hydrochloride

InChI: InChI=1/C4H6F3NO.ClH/c1-2(8)3(9)4(5,6)7;/h2H,8H2,1H3;1H

Composition: C (27.06%), H (3.97%), Cl (19.97%), F (32.10%), N (7.89%), O (9.01%)

Molar Mass: 177.55

Atom Count: 17

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	177.016826
Formal Charge	0
FSP3	0.75
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	SXDWHORMIVRFLQ-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	25.06
Topological Polar Surface Area	43.09
Polarizability	9.39
Ring Count	0
Rotatable Bond Count	2

Suppliers

Struchem co.,ltd

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	191981-64-3		$3,520.00-$6,300.00$3,520.00$4,840.00$6,300.00