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4-METHOXY-2-(TRIFLUOROMETHYL)BENZOICACID

4-METHOXY-2-(TRIFLUOROMETHYL)BENZOICACID structure

CAS No:
127817-85-0
Formula:
C9H7F3O3
Chemical Name:
4-METHOXY-2-(TRIFLUOROMETHYL)BENZOICACID
Synonyms:
RARECHEM AL BE 1192;4-METHOXY-2-(TRIFLUOROMETHYL)BENZOIC ACID;2-(Trifluoromethyl)-4-methoxybenzoic acid;2-(Trifluoromethyl)-p-anisic acid, 2-Carboxy-5-methoxybenzotrifluoride, 4-Carboxy-3-(trifluoromethyl)anisole;4-Methoxy-2-trifluormethylbenzoic acid;Benzoic acid, 4-methoxy-2-(trifluoromethyl)-;4-Methoxy-2-(Trifluoromethyl)BenzoicAci
Categories:
Organic Chemistry > Coordination Complexes

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4-METHOXY-2-(TRIFLUOROMETHYL)BENZOICACID Basic Attributes

Molecular Weight：

220.15

Exact Mass：

220.03472857

DSSTox ID：

DTXSID80379504

Characteristics

Density：

1.380±0.06 g/cm3

Melting Point：

147-150°C

Boiling Point：

274.8±40.0 °C(Predicted)

PKA：

3.50±0.36

Safety Information

Marks：

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 6 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:220.14
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:220.03472857
Monoisotopic Mass:220.03472857
Topological Polar Surface Area:46.5
Heavy Atom Count:15
Complexity:239
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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4-Methoxy-2-(trifluoromethyl)benzoic acid

CAS No.: 127817-85-0

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Guide of 4-METHOXY-2-(TRIFLUOROMETHYL)BENZOICACID

Basic Attributes
Characteristics
Safety Information
Computed Properties
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