CAS 61397-56-6

Chemistry, 2 End Use API, 29 Related Intermediates

Manufacturers/Suppliers

2 Suppliers

2 Suppliers

Also known as: Cis-bbd, 61397-56-6, 61397-57-7, Cis-[2-bromomethyl-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl]methyl benzoate, [(2r,4r)-2-(bromomethyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl]methyl benzoate, Trans-[2-bromomethyl-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl]methyl benzoate

Molecular Formula

C₁₈H₁₅BrCl₂O₄

Molecular Weight

446.1 g/mol

InChI Key

OXUPOIXSQGXRGF-KSSFIOAISA-N

1 2D Structure

CAS 61397-56-6

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

[(2R,4R)-2-(bromomethyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl]methyl benzoate

2.1.2 InChI

InChI=1S/C18H15BrCl2O4/c19-11-18(15-7-6-13(20)8-16(15)21)24-10-14(25-18)9-23-17(22)12-4-2-1-3-5-12/h1-8,14H,9-11H2/t14-,18-/m0/s1

2.1.3 InChI Key

OXUPOIXSQGXRGF-KSSFIOAISA-N

2.1.4 Canonical SMILES

C1C(OC(O1)(CBr)C2=C(C=C(C=C2)Cl)Cl)COC(=O)C3=CC=CC=C3

2.1.5 Isomeric SMILES

C1[C@@H](O[C@@](O1)(CBr)C2=C(C=C(C=C2)Cl)Cl)COC(=O)C3=CC=CC=C3

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. Cis-bbd

2. 61397-56-6

3. 61397-57-7

4. Cis-[2-bromomethyl-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl]methyl Benzoate

5. [(2r,4r)-2-(bromomethyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl]methyl Benzoate

6. Trans-[2-bromomethyl-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl]methyl Benzoate

7. [(2r,4s)-2-(bromomethyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl]methyl Benzoate

8. Schembl9096638

9. Dtxsid60976954

10. Zinc1253773

11. Mfcd07370171

12. Akos015963350

13. Ac-19910

14. Bs-32626

15. (2r)-2beta-(bromomethyl)-2-(2,4-dichlorophenyl)-1,3-dioxolane-4beta-methanol Benzoate

16. 1,3-dioxolane-4-methanol, 2-(bromomethyl)-2-(2,4-dichlorophenyl)-,benzoate, (2r,4r)-rel-

17. 1,3-dioxolane-4-methanol, 2-(bromomethyl)-2-(2,4-dichlorophenyl)-, Benzoate, (2r,4r)-rel-

2.3 Create Date

2005-07-11

3 Chemical and Physical Properties

Molecular Formula	C₁₈H₁₅BrCl₂O₄
Molecular Weight	446.1 g/mol
XLogP3	4.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	6
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	44.8
Heavy Atom Count	25
Formal Charge	0
Complexity	460
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

List of Suppliers

Full Screen View

Reset Filter

Ask Us

Zeon Pharma Industries India Pvt Lt...

Zeon is a manufacturer and supplier of APIs & Intermediates.

Contact Supplier

India

Virtual Booth

Digital Content

Itraconazole

PDF Supplier PDF

URL Supplier Web Content

CAS Number

61397-56-6

Intermediate Name

Cis-Bromo Benzoate (or) ( Cis-2-2,4...

About the Company

Zeon Pharma Industries India Pvt ltd is an ISO & GMP certified manufacturer & exporter of Bulk drugs / Se...

Zeon Pharma Industries India Pvt ltd is an ISO & GMP certified manufacturer & exporter of Bulk drugs / Semi finish formulations & Intermediate and also has a GMP certified Manufacturing facility for Phytochemicals / Herbal extract and Enzymes through our associates.

Zeon Pharma Industries India Pvt Ltd Company Banner

Vietnam Medi Pharm 2024

Not Confirmed

Contact Supplier

NAM Group

Upload your Marketing & Sales content on your company Virtual Booth, click HERE

Post an Enquiry

India

Virtual Booth

Digital Content

Ketoconazole

PDF Supplier PDF

URL Supplier Web Content

CAS Number

61397-56-6

Intermediate Name

Cis Bromo Benzoate

About the Company

NAM Group of Industries is a prominent manufacturer and exporter of pharmaceutical API’s for both human...

NAM Group of Industries is a prominent manufacturer and exporter of pharmaceutical API’s for both human and veterinary use, along with pharmaceutical intermediates. Our cutting-edge facility spans over 5000 square meters and is equipped with the latest technology and modern equipment. It adheres to WHO GMP & CGMP standards, ensuring compliance with global pharmaceutical regulations. Our facility includes dedicated clean rooms for each category, underscoring our commitment to maintaining high standards of hygiene and quality. It is headquartered in Mumbai, with our manufacturing plant situated in Ankleshwar, Gujarat.

ASK
US