2-Methoxy-4-nitrobenzaldehyde - CAS 136507-15-8
Catalog: |
BB008367 |
Product Name: |
2-Methoxy-4-nitrobenzaldehyde |
CAS: |
136507-15-8 |
Synonyms: |
2-methoxy-4-nitrobenzaldehyde |
IUPAC Name: | 2-methoxy-4-nitrobenzaldehyde |
Description: | 2-Methoxy-4-nitrobenzaldehyde (CAS# 136507-15-8) is used in perparation of N-((oxazolyl)phenyl)chromanecarboxamide derivatives as therapeutically active substances for the treatment of retinal diseases. |
Molecular Weight: | 181.15 |
Molecular Formula: | C8H7NO4 |
Canonical SMILES: | COC1=C(C=CC(=C1)[N+](=O)[O-])C=O |
InChI: | InChI=1S/C8H7NO4/c1-13-8-4-7(9(11)12)3-2-6(8)5-10/h2-5H,1H3 |
InChI Key: | LEBUUZXTHMCZQZ-UHFFFAOYSA-N |
Boiling Point: | 354.7 ℃ at 760 mmHg |
Melting Point: | 120-124 ℃ |
Purity: | 95 % |
Density: | 1.322 g/cm3 |
Appearance: | White to tan powder |
MDL: | MFCD02683052 |
LogP: | 1.93910 |
GHS Hazard Statement: | H317 (95%): May cause an allergic skin reaction [Warning Sensitization, Skin] |
Precautionary Statement: | P261, P272, P280, P302+P352, P321, P333+P313, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2020207749-A1 | Compounds for use as therapeutically active substances in the treatment of retinal diseases | 20181228 |
US-10807973-B2 | Compounds for use as therapeutically active substances in the treatment of retinal diseases | 20181228 |
WO-2020140050-A1 | N-(4-(oxazol-5-yl)phenyl)chromane-3-carboxamide derivatives and related compounds as stimulators of the production of retinal precursor cells for the treatment of neuroretinal diseases | 20181228 |
CN-113227086-A | N- (4- (oxazol-5-yl) phenyl) chroman-3-carboxamide derivatives and related compounds as stimulators of production of retinal precursor cells for the treatment of neuroretinal diseases | 20181228 |
KR-20210110652-A | Compounds for use as therapeutically active substances in the treatment and/or prophylaxis of neuroretinal diseases | 20181228 |
Complexity: | 201 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 181.03750770 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 181.03750770 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 72.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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