4-(trifluoromethoxy)butan-2-aminium chloride

4-(trifluoromethoxy)butan-2-aminium chloride

CAS: 1301739-19-4

Formula: C5H11ClF3NO

SMILES: [Cl-].CC([NH3+])CCOC(F)(F)F

IUPAC: 4-(trifluoromethoxy)butan-2-aminium chloride

InChI: InChI=1/C5H10F3NO.ClH/c1-4(9)2-3-10-5(6,7)8;/h4H,2-3,9H2,1H3;1H

Composition: C (31.02%), H (5.73%), Cl (18.31%), F (29.44%), N (7.24%), O (8.26%)

Molar Mass: 193.59

Atom Count: 22

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	193.0481262
Formal Charge	0
FSP3	1
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	VTCPYNIWVGYPFR-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	38.15
Topological Polar Surface Area	36.87
Polarizability	11.68
Ring Count	0
Rotatable Bond Count	4

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