1-Amino-2-methylpropan-2-ol - CAS 2854-16-2

Catalog:	BB019873
Product Name:	1-Amino-2-methylpropan-2-ol
CAS:	2854-16-2
Synonyms:	1-amino-2-methylpropan-2-ol

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	1-amino-2-methylpropan-2-ol
Description:	1-Amino-2-methylpropan-2-ol (CAS# 2854-16-2) is a versatile intermediate used for the synthesis of more complex compounds, including inhibitors. It is an intermediate in the preparation of metabolites of Darunavir (D193500), such as (A581405).
Molecular Weight:	89.14
Molecular Formula:	C4H11NO
Canonical SMILES:	CC(C)(CN)O
InChI:	InChI=1S/C4H11NO/c1-4(2,6)3-5/h6H,3,5H2,1-2H3
InChI Key:	LXQMHOKEXZETKB-UHFFFAOYSA-N
Boiling Point:	167.2 °C at 760 mmHg
Density:	0.93 g/cm³
LogP:	0.41630

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Related Functional Groups

Alcohols and Derivatives

[77987-49-6]
Z-Glycinol
[108100-06-7]
(S)-1-(2-Methoxyphenyl)ethanol
[1448610-48-7]
1-(4-Bromo-3-methylphenyl)cyclobutanol
[2006278-33-5]
2-(6-Methoxy-2-naphthyl)-4-pentyn-2-ol
[5272-36-6]
3-(Trimethylsilyl)propargyl alcohol
[2058331-75-0]
3-Bromo-1,1-difluoro-2-propanol

Nitrogen Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[333311-69-6]
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[1281984-38-0]
1-Cyclopentyl-3,5-dinitro-1H-pyrazole
[13021-14-2]
2,4,6-Trimethyl-N-methylaniline
[5724-76-5]
3-(2,5-Dioxopyrrolidin-1-yl)propionic acid
[2241982-86-3]
3-(Phenyl-2-D)propanenitrile-2,2-D2

Oxygen Compounds

[77987-49-6]
Z-Glycinol
[52378-69-5]
Diethyl trans-cinnamylphosphonate
[1281984-38-0]
1-Cyclopentyl-3,5-dinitro-1H-pyrazole
[202288-73-1]
2-(Pyridin-3-ylmethoxy)aniline dihydrochloride
[37503-42-7]
2-Hydroxyethyl bicyclo[2.2.1]hept-5-ene-2-carboxylate
[861434-97-1]
3-(2-Chloro-6-methylphenoxy)-5-nitroaniline

GHS Hazard Statement:	H302 (92.86%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	42.8
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	89.084063974
Formal Charge:	0
Heavy Atom Count:	6
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	89.084063974
Rotatable Bond Count:	1
Topological Polar Surface Area:	46.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.8