Methyl (3-Bromobenzoyl)acetate - CAS 294881-10-0
Catalog: |
BB020217 |
Product Name: |
Methyl (3-Bromobenzoyl)acetate |
CAS: |
294881-10-0 |
Synonyms: |
3-(3-bromophenyl)-3-oxopropanoic acid methyl ester; methyl 3-(3-bromophenyl)-3-oxopropanoate |
IUPAC Name: | methyl 3-(3-bromophenyl)-3-oxopropanoate |
Description: | Methyl (3-Bromobenzoyl)acetate (CAS# 294881-10-0) is a useful research chemical. |
Molecular Weight: | 257.08 |
Molecular Formula: | C10H9BrO3 |
Canonical SMILES: | COC(=O)CC(=O)C1=CC(=CC=C1)Br |
InChI: | InChI=1S/C10H9BrO3/c1-14-10(13)6-9(12)7-3-2-4-8(11)5-7/h2-5H,6H2,1H3 |
InChI Key: | ARQSZPQWKHRYTH-UHFFFAOYSA-N |
LogP: | 2.19490 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2006142284-A1 | Novel compounds | 20030227 |
US-7507834-B2 | Substituted anilinopyrazoles | 20030227 |
JP-2000264888-A | Bicyclic pyrimidine derivatives, intermediates for their production, methods for their production, and herbicides containing them as active ingredients | 19990111 |
JP-H11116506-A | Method for producing disubstituted alkane compounds | 19971013 |
Complexity: | 227 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 255.97351 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 255.97351 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 43.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
-
Catalog: BB015442
(±)-8a-Methyl-3,4,8,8a-tetrahydro-1,6(2H,7H)-naphthalenedione
Detail
-
Catalog: BB010056
(±)-cis-Cyclopentane-1,2-dicarboxylic acid
Detail
-
Catalog: BB027076
(±)-Diethyl trans-4-cyclohexene-1,2-dicarboxylate
Detail
-
Catalog: BB012630
(+)-Dibenzoyl-D-tartaric Acid
Detail
-
Catalog: BB021353
(+)-O,O'-Di-p-toluoyl-D-tartaric Acid
Detail
-
Catalog: BB030404
(-)-Citronellal
Detail
-
Catalog: BB033577
(-)-2,3:4,6-Di-O-isopropylidene-2-keto-L-gulonic Acid Monohydrate
Detail
-
Catalog: BB007475
(±)-cis-Bicyclo[3.2.0]hept-2-en-6-one
Detail
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS