Basic information
- CAS
10541-82-9- Standard SMILES
CCOC(=O)c1ccc(NC)cc1- InChIKey
VHTKEUCWOHEYLB-UHFFFAOYSA-N- Molecular formula
- C10H13NO2
- Average molar mass
- 179.22 g/mol
- Monoisotopic mass
- 179.09462866
Names & identifiers
- Preferred name
- Ethyl 4-(methylamino)benzoate
- IUPAC
- ethyl 4-(methylamino)benzoate
- English name
- ethyl 4-(methylamino)benzoate
- Molecular formula
- C10H13NO2
- Molecular weight
- 179.22
Names & synonyms
ethyl 4-(methylamino)benzoate10541-82-9DTXSID20312990RefChem:1084921DTXCID902641144-(Methylamino)benzoic Acid Ethyl EsterMFCD12025314Benzoic acid, 4-(methylamino)-, ethyl ester4-Ethoxycarbonyl-N-methylaniline; Ethyl 4-(Methylamino)benzoate; Ethyl p-(Methylamino)benzoate; NSC 265435;NSC265435Vitamin D2 Impurity 1ethyl4-(methylamino)benzoate
Show more names
NSC 265435RS RMA04421Ethyl p-(MethylaMino)benzoate4-Ethoxycarbonyl-N-Methylaniline
p-ethoxycarbonyl-methylanilineSCHEMBL3233695VHTKEUCWOHEYLB-UHFFFAOYSA-NETHYL 4-METHYLAMINOBENZOATEGEO-04018AKOS012392458NSC-265435DA-19162
Database identifiers
- CAS
10541-82-9- PubChem CID
- 319832
- DTXSID
DTXSID20312990- Nikkaji
- J1.881.507I
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 162
Physicochemical properties
- Melting point
- 63 °C · >63°C (dec.)
- Boiling point
- 292.7 · 292.7±23.0 °C(Predicted)
- Density
- 1.097 · 1.097±0.06 g/cm3(Predicted)
- storage temp.
- Refrigerator
- solubility
- DMSO (Slightly), Methanol (Slightly)
- pka
- 2.26 · 2.26±0.12(Predicted)
- form
- Solid
- color
- Pale Beige to Light Brown
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Applications
Uses4-(Methylamino)benzoic Acid Ethyl Ester (cas# 10541-82-9) is a compound useful in organic synthesis.
Upstream & downstream products
Downstream products
Suppliers17 total
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
山东博洛达生物科技有限公司0531-68651502 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
TLC梯尔希（南京）药物研发有限公司18012923235 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
南京博济达医药科技有限公司18762407961 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
河南誉康卓宁进出口有限公司13393721940 · [email protected]
Related reactions
8 records
Compound notes
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