200,000+ products from a single source!
sales@angenechem.com
116027-13-5 | 3(4H)-Quinazolineacetic acid, 2-chloro-6-iodo-, ethyl ester
CAS No: 116027-13-5 Catalog No: AG000BG8 MDL No:MFCD23703109
Product Description
Catalog Number:
AG000BG8
Chemical Name:
3(4H)-Quinazolineacetic acid, 2-chloro-6-iodo-, ethyl ester
CAS Number:
116027-13-5
Molecular Formula:
C12H12ClIN2O2
Molecular Weight:
378.5933
MDL Number:
MFCD23703109
IUPAC Name:
ethyl 2-(2-chloro-6-iodo-4H-quinazolin-3-yl)acetate
InChI:
InChI=1S/C12H12ClIN2O2/c1-2-18-11(17)7-16-6-8-5-9(14)3-4-10(8)15-12(16)13/h3-5H,2,6-7H2,1H3
InChI Key:
NHLCWNWOFSPPTP-UHFFFAOYSA-N
SMILES:
CCOC(=O)CN1Cc2cc(I)ccc2N=C1Cl
Properties
Complexity:
351
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
377.963g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
378.594g/mol
Monoisotopic Mass:
377.963g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
41.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.