Methyl 5-Bromo-2-methylbenzoate - CAS 79669-50-4
Catalog: |
BB036393 |
Product Name: |
Methyl 5-Bromo-2-methylbenzoate |
CAS: |
79669-50-4 |
Synonyms: |
5-bromo-2-methylbenzoic acid methyl ester; methyl 5-bromo-2-methylbenzoate |
IUPAC Name: | methyl 5-bromo-2-methylbenzoate |
Description: | Methyl 5-Bromo-2-methylbenzoate (CAS# 79669-50-4) is a useful research chemical. |
Molecular Weight: | 229.07 |
Molecular Formula: | C9H9BrO2 |
Canonical SMILES: | CC1=C(C=C(C=C1)Br)C(=O)OC |
InChI: | InChI=1S/C9H9BrO2/c1-6-3-4-7(10)5-8(6)9(11)12-2/h3-5H,1-2H3 |
InChI Key: | FDCYLMYCHALQJR-UHFFFAOYSA-N |
Boiling Point: | 258.9 °C at 760 mmHg |
Density: | 1.433 g/cm3 |
MDL: | MFCD09839555 |
LogP: | 2.54410 |
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 |
JP-2021152084-A | Pest control method | 20210702 |
CN-113149828-A | Preparation method of 5-bromo-2-methylbenzoic acid | 20210331 |
CN-112592247-A | Photocatalytic continuous bromination method | 20210302 |
CN-112592247-B | Photocatalytic continuous bromination method | 20210302 |
CN-111440120-A | Compound and application thereof in preparation of medicines for treating malaria | 20200325 |
Complexity: | 170 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 227.97859 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 227.97859 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 26.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
-
[94086-78-9]
Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate
-
[1984-15-2]
Methylenediphosphonic acid
-
[132182-92-4]
Pentane, 1,1,1,2,2,3,4,5,5,5-decafluoro-3-methoxy-4-(trifluoromethyl)-
-
[92-06-8]
m-Terphenyl
-
[3821-81-6]
3-Amino-2-fluoropropionic acid
-
[471915-89-6]
N-(3,4-Dihydroxyphenethyl)methacrylamide
INDUSTRY LEADERS TRUST OUR PRODUCTS