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 ℃ at 760 mmHg
Density:	0.93 g/cm³
LogP:	0.41630

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Related Functional Groups

Alcohols and Derivatives

[58287-18-6]
(1R)-1-(4-Nitrophenyl)ethanol
[64437-48-5]
(Z)-10-Hexadecenol
[112256-09-4]
1-Cyclopentyl-2-propyn-1-ol
[1017184-54-1]
3-Amino-2-(2-pyridylmethyl)-1-propanol
[155310-11-5]
3-Amino-2,2-difluoro-1-propanol
[189449-41-0]
4-Chloro-3-pyridinemethanol

Nitrogen Compounds

[55877-31-1]
1-Benzofuran-3-carbonitrile
[618-40-6]
1-Methyl-1-phenylhydrazine
[13021-14-2]
2,4,6-Trimethyl-N-methylaniline
[1170836-29-9]
3-(1',3'-Dimethyl-5-(trifluoromethyl)-1'H,2H-[3,4'-bipyrazol]-2-yl)propanenitrile
[2241982-86-3]
3-(Phenyl-2-D)propanenitrile-2,2-D2
[514801-07-1]
3-[(4-Chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde

Oxygen Compounds

[52378-69-5]
Diethyl trans-cinnamylphosphonate
[5896-75-3]
(Z)-N-(4-Phenylpiperazin-1-yl)-1-(2,3,4-trimethoxyphenyl)methanimine
[1263034-11-2]
[(2-Azido-3-hexadecoxypropoxy)-diphenylmethyl]benzene
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[5333-45-9]
1,2,3,5-Tetramethoxybenzene
[1053656-74-8]
10-(2-Tetrahydropyranyloxy)-8-decynoic acid

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