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1009306-52-8,MFCD07308466
Catalog No.:AA000353
1009306-52-8 | 3-Quinolinecarboxylic acid, 2-(chloromethyl)-4-methyl-, ethyl ester, hydrochloride (1:1)
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1g
97%
2 weeks  
$597.00   $418.00
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Technical Information
Catalog Number:
AA000353
Chemical Name:
3-Quinolinecarboxylic acid, 2-(chloromethyl)-4-methyl-, ethyl ester, hydrochloride (1:1)
CAS Number:
1009306-52-8
Molecular Formula:
C14H15Cl2NO2
Molecular Weight:
300.1804
MDL Number:
MFCD07308466
IUPAC Name:
ethyl 2-(chloromethyl)-4-methylquinoline-3-carboxylate;hydrochloride
InChI:
InChI=1S/C14H14ClNO2.ClH/c1-3-18-14(17)13-9(2)10-6-4-5-7-11(10)16-12(13)8-15;/h4-7H,3,8H2,1-2H3;1H
InChI Key:
KUKUZNRWSWRIKY-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c(CCl)nc2c(c1C)cccc2.Cl
Properties
Computed Properties
 
Complexity:
298  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.048g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
300.179g/mol
Monoisotopic Mass:
299.048g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
ethyl 2-(chloromethyl)-4-methylquinoline-3-carboxylate hydrochloride 
1009306-52-8 
ANW-64466 
MFCD07308466 
AKOS008965613 
NE40816 
SMR000376512 
DB-058534 
TC-153211 
FT-0706307 
FT-0764432 
Z2545 
C14H15Cl2NO2 
EN300-10045 
2-Chloromethyl-4-methyl-3-quinolinecarboxylic acid ethyl ester hydrochloride 
3-Quinolinecarboxylic acid, 2-(chloromethyl)-4-methyl-, ethyl ester, hydrochloride (1:1) 
Ethyl 2-(chloromethyl)-4-methylquinoline-3-carboxylate--hydrogen chloride (1/1) 
790263-88-6 
Ethyl 2-(chloromethyl)-4-methylquinoline-3-carboxylate hydrochloride, 97% - 1G 1g 
AC1Q39WN 
MLS000771932 
CHEMBL1443266 
CTK6F5324 
DTXSID50583277 
REGID_for_CID_16196351 
0297AA 
Literature
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