CAS 107512-34-5

1 2D Structure

CAS 107512-34-5

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

4-chloro-3-methoxy-2-methylpyridine

2.1.2 InChI

InChI=1S/C7H8ClNO/c1-5-7(10-2)6(8)3-4-9-5/h3-4H,1-2H3

2.1.3 InChI Key

RYGXNMUVOHCPBF-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CC1=NC=CC(=C1OC)Cl

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 107512-34-5

2. Pyridine, 4-chloro-3-methoxy-2-methyl-

3. 4-chloro-3-methoxy-2-methyl-pyridine

4. Schembl900450

5. Dtxsid50441989

6. Albb-027299

7. 2-methyl-3-methoxy-4-chloropyridine

8. Mfcd16610605

9. Zinc39038289

10. Akos016845851

11. Pb19448

12. As-34796

13. Cs-0050928

14. En300-101405

15. A895430

16. 2,2-bi-9h-fluorene,7-bromo-9,9,9,9-tetraethyl-

2.3 Create Date

2006-10-25

3 Chemical and Physical Properties

Molecular Formula	C₇H₈ClNO
Molecular Weight	157.60 g/mol
XLogP3	1.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	22.1
Heavy Atom Count	10
Formal Charge	0
Complexity	110
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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