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Chemistry

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Also known as: 916792-10-4, 2-chloro[1,3]oxazolo[5,4-c]pyridine, 2-chloro-[1,3]oxazolo[5,4-c]pyridine, Mfcd07781161, Schembl21583676, Dtxsid10672616
Molecular Formula
C6H3ClN2O
Molecular Weight
154.55  g/mol
InChI Key
CVNMRDXBPVOJFI-UHFFFAOYSA-N

CAS 916792-10-4
1 2D Structure

CAS 916792-10-4

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-chloro-[1,3]oxazolo[5,4-c]pyridine
2.1.2 InChI
InChI=1S/C6H3ClN2O/c7-6-9-4-1-2-8-3-5(4)10-6/h1-3H
2.1.3 InChI Key
CVNMRDXBPVOJFI-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CN=CC2=C1N=C(O2)Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 916792-10-4

2. 2-chloro[1,3]oxazolo[5,4-c]pyridine

3. 2-chloro-[1,3]oxazolo[5,4-c]pyridine

4. Mfcd07781161

5. Schembl21583676

6. Dtxsid10672616

7. Zinc55045520

8. Akos016002492

9. Sy273675

10. Ts-02063

11. A860263

2.3 Create Date
2010-06-22
3 Chemical and Physical Properties
Molecular Weight 154.55 g/mol
Molecular Formula C6H3ClN2O
XLogP31.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass153.9933904 g/mol
Monoisotopic Mass153.9933904 g/mol
Topological Polar Surface Area38.9 Ų
Heavy Atom Count10
Formal Charge0
Complexity133
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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