3-Amino-1,1,1-trifluoro-2-propanol Hydrochloride - CAS 3832-24-4

Catalog:	BB023634
Product Name:	3-Amino-1,1,1-trifluoro-2-propanol Hydrochloride
CAS:	3832-24-4
Synonyms:	3-amino-1,1,1-trifluoro-2-propanol;hydrochloride; 3-amino-1,1,1-trifluoropropan-2-ol;hydrochloride

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Computed Properties

IUPAC Name:	3-amino-1,1,1-trifluoropropan-2-ol;hydrochloride
Description:	3-Amino-1,1,1-trifluoro-2-propanol Hydrochloride (CAS# 3832-24-4) is a useful research chemical.
Molecular Weight:	165.54
Molecular Formula:	C3H7ClF3NO
Canonical SMILES:	C(C(C(F)(F)F)O)N.Cl
InChI:	InChI=1S/C3H6F3NO.ClH/c4-3(5,6)2(8)1-7;/h2,8H,1,7H2;1H
InChI Key:	DHSCPPZGIAEZHF-UHFFFAOYSA-N
Boiling Point:	216.2 °C at 760 mmHg
Density:	1.344 g/cm³
MDL:	MFCD07784296
LogP:	1.37060

Publication Number	Title	Priority Date
WO-2021094209-A1	Substituted pyrrolo triazine carboxamide derivatives as prostaglandin ep3 receptor antagonists	20191112
CN-113348165-A	1,2, 4-triazin-3 (2H) -one compounds for the treatment of hyperproliferative diseases	20190201
WO-2019219517-A1	Substituted dihydropyrazolo pyrazine carboxamide derivatives	20180517
AU-2019270142-A1	Substituted dihydropyrazolo pyrazine carboxamide derivatives	20180517
TW-202012408-A	Substituted dihydropyrazolopyridine carboxamide derivatives	20180517

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	71.4
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	165.0168260
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	165.0168260
Rotatable Bond Count:	1
Topological Polar Surface Area:	46.2 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0