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874649-82-8
Also known as: 874649-82-8, Methyl 6-fluorochromane-2-carboxylate, Methyl 6-fluoro-3,4-dihydro-2h-chromene-2-carboxylate, Rac-6-fluoro-3,4-dihydro-2h-1-benzopyran-2-carboxylic acid methyl ester, Methyl 6-fluoro-3,4-dihydro-2h-1-benzopyran-2-carboxylate, Schembl2005546
Molecular Formula
C11H11FO3
Molecular Weight
210.20  g/mol
InChI Key
QAYAXMIKHJVIJM-UHFFFAOYSA-N

1 2D Structure

874649-82-8

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
methyl 6-fluoro-3,4-dihydro-2H-chromene-2-carboxylate
2.1.2 InChI
InChI=1S/C11H11FO3/c1-14-11(13)10-4-2-7-6-8(12)3-5-9(7)15-10/h3,5-6,10H,2,4H2,1H3
2.1.3 InChI Key
QAYAXMIKHJVIJM-UHFFFAOYSA-N
2.1.4 Canonical SMILES
COC(=O)C1CCC2=C(O1)C=CC(=C2)F
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 874649-82-8

2. Methyl 6-fluorochromane-2-carboxylate

3. Methyl 6-fluoro-3,4-dihydro-2h-chromene-2-carboxylate

4. Rac-6-fluoro-3,4-dihydro-2h-1-benzopyran-2-carboxylic Acid Methyl Ester

5. Methyl 6-fluoro-3,4-dihydro-2h-1-benzopyran-2-carboxylate

6. Schembl2005546

7. Dtxsid00595128

8. Mfcd09701969

9. Akos015853416

10. Ds-2072

11. Ts-02990

12. 2-methylamino-1-phenylethanonehydrochloride

13. Cs-0001991

14. Ft-0658816

15. M2879

16. A842225

17. 2h-1-benzopyran-2-carboxylicacid,6-fluoro-3,4-dihydro-,methyl Ester

2.3 Create Date
2007-12-04
3 Chemical and Physical Properties
Molecular Weight 210.20 g/mol
Molecular Formula C11H11FO3
XLogP32.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass g/mol
Monoisotopic Mass g/mol
Topological Polar Surface Area35.5
Heavy Atom Count15
Formal Charge0
Complexity244
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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CAS-99199-90-3
Nebivolol
We are Rampex Labs, a fully cGMP compliant pharmaceutical intermediates plant located in the outskirts of...
We are Rampex Labs, a fully cGMP compliant pharmaceutical intermediates plant located in the outskirts of Hyderabad, India. Our company was founded in 2004 with commercial operations starting initially by outsourcing our production. In January 2008, our own production became operational and our journey really began. From our inception, we have strived to be the best and work with the best. Our client list comprises of some of the leading API producers within India and abroad. We at Rampex strongly believe that commitment to quality and timely deliveries ensure a very smooth working relationship with all our customers.
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CAS-99199-60-7
Nebivolol
We are Rampex Labs, a fully cGMP compliant pharmaceutical intermediates plant located in the outskirts of...
We are Rampex Labs, a fully cGMP compliant pharmaceutical intermediates plant located in the outskirts of Hyderabad, India. Our company was founded in 2004 with commercial operations starting initially by outsourcing our production. In January 2008, our own production became operational and our journey really began. From our inception, we have strived to be the best and work with the best. Our client list comprises of some of the leading API producers within India and abroad. We at Rampex strongly believe that commitment to quality and timely deliveries ensure a very smooth working relationship with all our customers.
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