Methyl 4-Chloroquinoline-2-carboxylate - CAS 114935-92-1
Catalog: |
BB003451 |
Product Name: |
Methyl 4-Chloroquinoline-2-carboxylate |
CAS: |
114935-92-1 |
Synonyms: |
4-chloro-2-quinolinecarboxylic acid methyl ester; methyl 4-chloroquinoline-2-carboxylate |
IUPAC Name: | methyl 4-chloroquinoline-2-carboxylate |
Description: | Methyl 4-Chloroquinoline-2-carboxylate (CAS# 114935-92-1) is a useful research chemical. |
Molecular Weight: | 221.64 |
Molecular Formula: | C11H8ClNO2 |
Canonical SMILES: | COC(=O)C1=NC2=CC=CC=C2C(=C1)Cl |
InChI: | InChI=1S/C11H8ClNO2/c1-15-11(14)10-6-8(12)7-4-2-3-5-9(7)13-10/h2-6H,1H3 |
InChI Key: | AAHYMHHQOLSODU-UHFFFAOYSA-N |
MDL: | MFCD14706446 |
LogP: | 2.67480 |
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-2004272338-A1 | Pyrrol derivatives with antibacterial activity | 20030913 |
CA-2538552-A1 | Pyrrol derivatives with antibacterial activity | 20030913 |
CN-1882568-A | Pyrrol derivatives with antibacterial activity | 20030913 |
DE-602004009089-T2 | PYRROL DERIVATIVES WITH ANTIBACTERIAL EFFECT | 20030913 |
EP-1664025-A1 | Pyrrol derivatives with antibacterial activity | 20030913 |
Complexity: | 247 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 221.0243562 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 221.0243562 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 39.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS