Methyl 2-amino-4-(trifluoromethyl)benzoate, 95%

Name: Methyl 2-amino-4-(trifluoromethyl)benzoate
Brand: Chempure

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CAS Number

61500-87-6

Molecular Weight

219.16

Formula

C9H8F3NO2

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IUPAC name	methyl 2-amino-4-(trifluoromethyl)benzoate
inchi	InChI=1S/C9H8F3NO2/c1-15-8(14)6-3-2-5(4-7(6)13)9(10,11)12/h2-4H,13H2,1H3
inchi key	DZICUHOFOOPVFM-UHFFFAOYSA-N
molecular formula	C9H8F3NO2
synonyms	methyl 2-amino-4-(trifluoromethyl)benzoate 61500-87-6 2-AMINO-4-TRIFLUOROMETHYL-BENZOIC ACID METHYL ESTER MFCD08543939 CHEMBL5085731

Computed Properties

Molecular Weight:	219.16 g/mol
XLogP3:	2.8
Hydrogen Bond Donor Count:	1
Hydrogen Bond Acceptor Count:	6
Rotatable Bond Count:	2
Exact Mass:	219.05071298 g/mol
Monoisotopic Mass:	219.05071298 g/mol
Topological Polar Surface Area:	52.3 Å²
Heavy Atom Count:	15
Formal Charge:	0
Complexity:	242
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

hazard signal	Warning
hazard classes and categories	Acute Tox. 4 (50%) Skin Irrit. 2 (100%) Eye Irrit. 2 (100%) STOT SE 3 (50%)
precautionary statement codes	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
hazard statements	H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (50%): 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 (50%): Harmful if inhaled [Warning Acute toxicity, inhalation] H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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Product No: AQ5459

Methyl 2-amino-4-(trifluoromethyl)benzoate, 95%

Product No: AQ5459

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NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?