2-(2-Bromo-6-chlorophenyl)acetic Acid - CAS 37777-77-8
Catalog: |
BB061844 |
Product Name: |
2-(2-Bromo-6-chlorophenyl)acetic Acid |
CAS: |
37777-77-8 |
Synonyms: |
2-Chloro-6-bromophenylacetic Acid; 2-Bromo-6-chlorobenzeneacetic Acid |
IUPAC Name: | 2-(2-bromo-6-chlorophenyl)acetic acid |
Description: | 2-(2-Bromo-6-chlorophenyl)acetic Acid can be used as plant growth-regulating substances. |
Molecular Weight: | 249.49 |
Molecular Formula: | C8H6O2ClBr |
Canonical SMILES: | C1=CC(=C(C(=C1)Br)CC(=O)O)Cl |
InChI: | InChI=1S/C8H6BrClO2/c9-6-2-1-3-7(10)5(6)4-8(11)12/h1-3H,4H2,(H,11,12) |
InChI Key: | KTPDPINDCZGYEC-UHFFFAOYSA-N |
Melting Point: | 159 - 161°C |
Solubility: | Chloroform (Slightly), Methanol (Slightly) |
Appearance: | White to Off-White Solid |
Storage: | -20°C, Inert atmosphere |
References: | Chamberlain, V.K., et.al. Ann. Appl. Biol., 69, 65-72, (1971). |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/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 |
EP-3517112-A1 | Heteroaryl compounds useful as inhibitors of sumo activating enzyme | 20140701 |
US-10335410-B2 | Heteroaryl compounds useful as inhibitors of sumo activating enzyme | 20140701 |
US-2016009744-A1 | Heteroaryl compounds useful as inhibitors of sumo activating enzyme | 20140701 |
US-2017002032-A9 | Heteroaryl compounds useful as inhibitors of sumo activating enzyme | 20140701 |
US-2017216290-A1 | Heteroaryl compounds useful as inhibitors of sumo activating enzyme | 20140701 |
US-2018311239-A1 | Heteroaryl compounds useful as inhibitors of sumo activating enzyme | 20140701 |
US-2020085821-A1 | Heteroaryl compounds useful as inhibitors of sumo activating enzyme | 20140701 |
US-9683003-B2 | Heteroaryl compounds useful as inhibitors of SUMO activating enzyme | 20140701 |
US-9962386-B2 | Heteroaryl compounds useful as inhibitors of SUMO activating enzyme | 20140701 |
WO-2016004136-A1 | Heteroaryl compounds useful as inhibitors of sumo activating enzyme | 20140701 |
Complexity: | 174 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 247.92397 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 247.92397 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 37.3Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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