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4-Amino-3-fluorophenol

4-Amino-3-fluorophenol structure

CAS No:
399-95-1
Formula:
C6H6FNO
Chemical Name:
4-Amino-3-fluorophenol
Synonyms:
Phenol,4-amino-3-fluoro-;4-Amino-3-fluorophenol;3-Fluoro-4-aminophenol;2-Fluoro-4-hydroxyaniline
Categories:
Agrochemicals > Pesticide Intermediates

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Description

Dark Brown Solid

4-Amino-3-fluorophenol Basic Attributes

Molecular Weight：

127.116

Exact Mass：

127.12

EC Number：

402-230-0

DSSTox ID：

DTXSID60192950

HScode：

2922299090

Characteristics

PSA：

46.25000

XLogP3：

1.1

Appearance：

Brown crystal

Density：

1.3±0.1 g/cm3

Melting Point：

139 °C

Boiling Point：

270.4±25.0 °C at 760 mmHg

Flash Point：

117.3±23.2 °C

Refractive Index：

1.602

Safety Information

Packing level：

III

Hazard category：

Transport codes：

3077

hazard class code：

R22

safety instructions：

S45-S53-S61

Marks：

T,Xi,N

Precautionary statement(s)：

P201, P202, P261, P264, P270, P272, P273, P280, P281, P301+P312, P302+P352, P308+P313, P321, P330, P333+P313, P363, P391, P405, P501

Hazard Statements：

H302

GHS Classification：

|Danger|H302: Harmful if swallowed [Warning Acute toxicity, oral]|P201, P202, P261, P264, P270, P272, P273, P280, P281, P301+P312, P302+P352, P308+P313, P321, P330, P333+P313, P363, P391, P405, and P501|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|Aggregated GHS information provided by 3 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|H301 (25%): Toxic if swallowed [Danger Acute toxicity, oral]|P201, P202, P260, P261, P264, P270, P271, P272, P273, P280, P281, P301+P310, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P308+P313, P310, P311, P312, P321, P322, P330, P332+P313, P333+P313, P337+P313, P361, P362, P363, P391, P403+P233, P405, and P501|Aggregated GHS information provided by 8 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|Not Classified

Computed Properties

Molecular Weight:127.12
XLogP3:1.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Exact Mass:127.043341977
Monoisotopic Mass:127.043341977
Topological Polar Surface Area:46.2
Heavy Atom Count:9
Complexity:99.1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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