Benzenamine, 2-chloro-4-fluoro-

HCID 75013CAS 2106-02-7
Substructure searchFind similar structures

Basic information

Standard SMILES
Nc1ccc(F)cc1Cl
InChIKey
XRAKCYJTJGTSMM-UHFFFAOYSA-N
Molecular formula
C6H5ClFN
Average molar mass
145.56 g/mol
Monoisotopic mass
145.009455

Names & identifiers

Preferred name
Benzenamine, 2-chloro-4-fluoro-
IUPAC
2-chloro-4-fluoroaniline
English name
2-Chloro-4-fluoroaniline
Molecular formula
C6H5ClFN
Molecular weight
145.56

Names & synonyms

2-Chloro-4-fluoroaniline2106-02-7Benzenamine, 2-chloro-4-fluoro-2-chloro-4-fluorobenzenamineDTXSID5062182EINECS 218-282-0RefChem:561683DTXCID6036419218-282-0MFCD000425302-chloro-4-fluorophenylamine4-fluoro-2-chloroaniline
Show more names
2-chloro-4-fluoroaniline hydrochlorideCHLOROFLUOROANILINETIMTEC-BB SBB0041102-Chloro-4-fluoroani2-Chloro-4-fluoroniline2-Chloro-4-fuoroaniline
2-chloro-4-fluoro-aniline2-chloro-4-fluoro-phenylamine2-chloro-4fluoroaniline2-chloro-4-fluroaniline2-chloro-4-fluoro anilineSCHEMBL109905SCHEMBL2318248SCHEMBL7002860

Database identifiers

CAS
2106-02-7
PubChem CID
75013
DTXSID
DTXSID5062182
ChEMBL
CHEMBL2323849
UNII
K77X364T56
EC Number
218-282-0
Nikkaji
J208.274H

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
26 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
9

Physicochemical properties

Boiling point
192 °C · 192 °C (lit.)
Density
1.219 g/mL · 1.219 g/mL at 25 °C (lit.)
refractive index
20 · n20/D 1.554(lit.)
Flash point
209 °F · 209 °F
storage temp.
Keep in dark place,Inert atmosphere,Room temperature
pka
2.71 · 2.71±0.10(Predicted)

Safety & regulation

GHS classification

GHS Classification · 5 items

Warning

H302 (97.9%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (89.6%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (97.9%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (89.6%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]；H373 (12.5%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure]

P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 48 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (97.9%)；Acute Tox. 4 (89.6%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；Acute Tox. 4 (97.9%)；STOT SE 3 (89.6%)；STOT RE 2 (12.5%)

Safety data

PPE
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
wgk
3
tsca
TSCA listed
ridadr
2810
hs_code
29214200
risk_code
20/21/22-36/37/38

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationBenzenamine, 2-chloro-4-fluoro-: INACTIVE

Applications

Uses2-Chloro-4-fluoroaniline is used as pharmaceutical, pesticide, and liquid crystal material intermediates.

Upstream & downstream products

Suppliers50 total

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海策嵘生物科技有限公司[email protected]
合肥翰刚医药科技有限公司+8618062405514 · [email protected]

Related reactions

34 records
New reaction record

Linked notes

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