4-Amino-3,5-difluorophenol - CAS 135086-76-9

Catalog:	BB008075
Product Name:	4-Amino-3,5-difluorophenol
CAS:	135086-76-9
Synonyms:	4-amino-3,5-difluorophenol; 4-amino-3,5-difluorophenol

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	4-amino-3,5-difluorophenol
Description:	4-Amino-3,5-difluorophenol (CAS# 135086-76-9) is a useful intermediate for the preparation of 1-(Adamantan-1-ylcarbonyl)-3-(2,6-difluoro-4-hydroxyphenyl)thiourea and other aniline derivatives.
Molecular Weight:	145.11
Molecular Formula:	C6H5F2NO
Canonical SMILES:	C1=C(C=C(C(=C1F)N)F)O
InChI:	InChI=1S/C6H5F2NO/c7-4-1-3(10)2-5(8)6(4)9/h1-2,10H,9H2
InChI Key:	YHQVBHFKCBFNEG-UHFFFAOYSA-N
Boiling Point:	250 °C at 760 mmHg
Density:	1.472 g/cm³
Appearance:	Brown powder
Storage:	Sealed in dry, 2-8 °C
MDL:	MFCD03094491
LogP:	1.83380

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Related Functional Groups

Amines and Anilines

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Pseudothiohydantoin
[1250876-38-0]
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[1184994-08-8]
2,2-Dimethyl-1-pyrazol-1-ylmethyl-propylamine hydrochloride
[1239647-61-0]
2-Amino-6-methyl-[1,2,4]triazolo[1,5-a]pyridine
[105512-81-0]
2-Amino-4-(3-bromophenyl)thiazole
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2-Ethyl-4-(methylsulfonyl)aniline

GHS Hazard Statement:	H301 (33.33%): Toxic if swallowed [Danger Acute toxicity, oral]; H302 (66.67%): Harmful if swallowed [Warning Acute toxicity, oral]; H311 (33.33%): Toxic in contact with skin [Danger Acute toxicity, dermal]; H312 (66.67%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H314 (33.33%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]; H315 (66.67%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (66.67%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H331 (16.67%): Toxic if inhaled [Danger Acute toxicity, inhalation]; H335 (66.67%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P260, P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P363, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	110
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	145.03392011
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	145.03392011
Rotatable Bond Count:	0
Topological Polar Surface Area:	46.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.1