Methyl 4-Amino-3,5-dibromobenzoate - CAS 3282-10-8
Catalog: |
BB021426 |
Product Name: |
Methyl 4-Amino-3,5-dibromobenzoate |
CAS: |
3282-10-8 |
Synonyms: |
4-amino-3,5-dibromobenzoic acid methyl ester; methyl 4-amino-3,5-dibromobenzoate |
IUPAC Name: | methyl 4-amino-3,5-dibromobenzoate |
Description: | Methyl 4-Amino-3,5-dibromobenzoate (CAS# 3282-10-8) is a useful research chemical. |
Molecular Weight: | 308.95 |
Molecular Formula: | C8H7Br2NO2 |
Canonical SMILES: | COC(=O)C1=CC(=C(C(=C1)Br)N)Br |
InChI: | InChI=1S/C8H7Br2NO2/c1-13-8(12)4-2-5(9)7(11)6(10)3-4/h2-3H,11H2,1H3 |
InChI Key: | CEKVGQOFHYOXSE-UHFFFAOYSA-N |
Boiling Point: | 362.4 ℃ at 760 mmHg |
Density: | 1.907 g/cm3 |
LogP: | 3.16160 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
AU-2015274960-A1 | Pesticidal compositions and processes related thereto | 20140609 |
AU-2015274960-B2 | Pesticidal compositions and processes related thereto | 20140609 |
BR-102015013221-A2 | pesticide compositions and processes related thereto | 20140609 |
CA-2951262-A1 | Pesticidal compositions and processes related thereto | 20140609 |
EP-3152189-A1 | Pesticidal compositions and processes related thereto | 20140609 |
Complexity: | 189 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 308.88230 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 306.88435 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 52.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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