3-Amino-4-methoxybenzanilide
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Basic information
- CAS
120-35-4- Standard SMILES
COc1ccc(C(=O)Nc2ccccc2)cc1N- InChIKey
LHMQDVIHBXWNII-UHFFFAOYSA-N- Molecular formula
- C14H14N2O2
- Average molar mass
- 242.27 g/mol
- Monoisotopic mass
- 242.10552769
Names & identifiers
- Preferred name
- 3-Amino-4-methoxybenzanilide
- IUPAC
- 3-amino-4-methoxy-N-phenylbenzamide
- English name
- 3-Amino-4-methoxybenzanilide
- Molecular formula
- C14H14N2O2
- Molecular weight
- 242.27
Names & synonyms
3-Amino-4-methoxybenzanilide120-35-43-Amino-4-methoxy-N-phenylbenzamide3-Amino-p-anisanilideBenzamide, 3-amino-4-methoxy-N-phenyl-p-Anisanilide, 3-amino-3-Amino-4-methoxy benzanilideBENZANILIDE, 3-AMINO-4-METHOXY-EINECS 204-388-4NSC 50647V5Y646AW8SNSC-50647
Show more names
Red based KDAMBAAMANRed KD BaseFAST RED KD BASELABOTEST-BB LT011385454-Methoxy-3-aminobenzanilide3-amino-4-methoxy-benzanilid
DTXSID0051607LHMQDVIHBXWNII-UHFFFAOYSA-EC 204-388-4RefChem:497289DTXCID1030159p-Anisanilide, 3-amino-(8CI)204-388-4InChI=1/C14H14N2O2/c1-18-13-8-7-10(9-12(13)15)14(17)16-11-5-3-2-4-6-11/h2-9H,15H2,1H3,(H,16,17)
Database identifiers
- CAS
120-35-4- PubChem CID
- 8426
- DTXSID
DTXSID0051607- UNII
- V5Y646AW8S
- EC Number
- 204-388-4
- Nikkaji
- J5.324D
Properties
Computed structural propertiesFilling in
- XLogP
- 2
- Topological polar surface area
- 64.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 277
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physical DescriptionCBI
Physicochemical properties
- Melting point
- 154 · 154-156°C
- Boiling point
- 385.1 °C · 385.1°C (rough estimate)
- Density
- 1.1338 · 1.1338 (rough estimate)
- vapor pressure
- 0 · 0-0Pa at 25℃
- refractive index
- 1.6419 · 1.6419 (estimate)
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- solubility
- DMSO (Slightly), Methanol (Slightly)
- form
- Solid
- pka
- 13.44 · 13.44±0.70(Predicted)
- color
- White to Off-White
- InChI
- InChI=1S/C14H14N2O2/c1-18-13-8-7-10(9-12(13)15)14(17)16-11-5-3-2-4-6-11/h2-9H,15H2,1H3,(H,16,17)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 70% (7 of 10) of all reports.
Warning
H315 (30%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 10 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Benzamide, 3-amino-4-methoxy-N-phenyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzamide, 3-amino-4-methoxy-N-phenyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Status: Active Update: 06-03-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/11279
Hazard Classes and CategoriesSkin Irrit. 2 (30%)
Safety data
- tsca
- TSCA listed
- rtecs
- CV7400000
- hs_code
- 2924297099
- Toxicity
- mouse,LD50,intravenous,320mg/kg (320mg/kg),U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#01183,
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
Chemistry & industry
Uses & manufacturing
U.S. Production2023: 50,000 - <250,000 lb
Consumer UsesPigment
Industry UsesPigment
General Manufacturing Information
Paint and Coating Manufacturing
Benzamide, 3-amino-4-methoxy-N-phenyl-: ACTIVE
Applications
Uses3-Amino-4-methoxybenzanilide is used in preparation method of Cyanate resin-based near-zero expansion composite material truss rod.
UsesDyes, pharmaceuticals, and other organic chemicals.
Upstream & downstream products
Upstream raw materials
Downstream products
Related reactions
152 records
Compound notes
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