Suanfarma Suanfarma

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CAS 179688-53-0 manufacturers and suppliers on PharmaCompass

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CAS 179688-53-0
Also known as:
Molecular Formula
C11H10N2O4
Molecular Weight
234.21  g/mol
InChI Key
SOLQIFINSOHAQD-UHFFFAOYSA-N

1 2D Structure

CAS 179688-53-0

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(7-methoxy-4-oxo-1H-quinazolin-6-yl) acetate
2.1.2 InChI
InChI=1S/C11H10N2O4/c1-6(14)17-10-3-7-8(4-9(10)16-2)12-5-13-11(7)15/h3-5H,1-2H3,(H,12,13,15)
2.1.3 InChI Key
SOLQIFINSOHAQD-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC(=O)OC1=C(C=C2C(=C1)C(=O)N=CN2)OC
2.1.5 Isomeric SMILES
CC(=O)OC1=C(C=C2C(=C1)C(=O)N=CN2)OC
2.2 Create Date
2007-12-05
3 Chemical and Physical Properties
Molecular Weight 234.21 g/mol
Molecular Formula C11H10N2O4
XLogP30.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass234.06405680 g/mol
Monoisotopic Mass234.06405680 g/mol
Topological Polar Surface Area77 A^2
Heavy Atom Count17
Formal Charge0
Complexity355
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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Digital Content Digital Content
URL Supplier Web Content
1066-54-2
Erlotinib
We are a top producer of Pharmaceutical Intermediates, Specialty Chemicals, and More, with origins dating...
We are a top producer of Pharmaceutical Intermediates, Specialty Chemicals, and More, with origins dating back to 1998. Globally renowned for its Organic Compounds, Inorganic Compounds, Industrial Acids, Industrial Chemicals, Zinc Acetates, Calcium Chloride Dihydrates, Speciality Chemicals, and other products, Sagar Life Science Private Limited is a customer-centric business with a primary focus on innovations, quality, and customization. Since sustainability is among our core values, we concentrate on improving the efficiency of our processes to manufacture sustainable results.
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