3-(2-Methoxyphenyl)aniline - CAS 96923-01-2
Catalog: |
BB042018 |
Product Name: |
3-(2-Methoxyphenyl)aniline |
CAS: |
96923-01-2 |
Synonyms: |
3-(2-methoxyphenyl)aniline; 3-(2-methoxyphenyl)aniline |
IUPAC Name: | 3-(2-methoxyphenyl)aniline |
Description: | 3-(2-Methoxyphenyl)aniline (CAS# 96923-01-2) is a useful research chemical. |
Molecular Weight: | 199.25 |
Molecular Formula: | C13H13NO |
Canonical SMILES: | COC1=CC=CC=C1C2=CC(=CC=C2)N |
InChI: | InChI=1S/C13H13NO/c1-15-13-8-3-2-7-12(13)10-5-4-6-11(14)9-10/h2-9H,14H2,1H3 |
InChI Key: | STGKTIFPGDMGOG-UHFFFAOYSA-N |
Boiling Point: | 340.3 ℃ at 760 mmHg |
Density: | 1.1 g/cm3 |
Storage: | Sealed in dry, 2-8 ℃ |
MDL: | MFCD03424666 |
LogP: | 4.32760 |
GHS Hazard Statement: | H302 (33.33%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2020134569-A1 | Preparation of n^n^c^o tetradentate platinum (ii) complex and uses thereof | 20181228 |
EP-3383859-A1 | 1-cyano-pyrrolidine derivatives as inhibitors of usp30. | 20151130 |
EP-3383859-B1 | 1-cyano-pyrrolidine derivatives as inhibitors of usp30 | 20151130 |
JP-2019501142-A | 1-cyanopyrrolidine derivatives as inhibitors of USP30 | 20151130 |
WO-2017093718-A1 | 1-cyano-pyrrolidine derivatives as inhibitors of usp30. | 20151130 |
Complexity: | 195 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 199.099714038 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 199.099714038 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 35.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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