CAS 201677-59-0

Chemistry, 2 End Use API, 1 Related Intermediates

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Also known as: 201677-59-0, (r)-n-(2-(benzyloxy)-5-(2-bromo-1-hydroxyethyl)phenyl)formamide, N-[5-[(1r)-2-bromo-1-hydroxyethyl]-2-phenylmethoxyphenyl]formamide, (r)-n-[2-benzyloxy-5-(2-bromo-1-hydroxy-ethyl)-phenyl]-formamide, (r)-n-[2-(benzyloxy)-5-(2-bromo-1-hydroxyethyl)phenyl]formamide, N-[5-[(1r)-2-bromo-1-hydroxyethyl]-2-(phenylmethoxy)phenyl]formamide

Molecular Formula

C₁₆H₁₆BrNO₃

Molecular Weight

350.21 g/mol

InChI Key

HKSUZIIGCSOMPX-HNNXBMFYSA-N

1 2D Structure

CAS 201677-59-0

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

N-[5-[(1R)-2-bromo-1-hydroxyethyl]-2-phenylmethoxyphenyl]formamide

2.1.2 InChI

InChI=1S/C16H16BrNO3/c17-9-15(20)13-6-7-16(14(8-13)18-11-19)21-10-12-4-2-1-3-5-12/h1-8,11,15,20H,9-10H2,(H,18,19)/t15-/m0/s1

2.1.3 InChI Key

HKSUZIIGCSOMPX-HNNXBMFYSA-N

2.1.4 Canonical SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C(CBr)O)NC=O

2.1.5 Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)[C@H](CBr)O)NC=O

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 201677-59-0

2. (r)-n-(2-(benzyloxy)-5-(2-bromo-1-hydroxyethyl)phenyl)formamide

3. N-[5-[(1r)-2-bromo-1-hydroxyethyl]-2-phenylmethoxyphenyl]formamide

4. (r)-n-[2-benzyloxy-5-(2-bromo-1-hydroxy-ethyl)-phenyl]-formamide

5. (r)-n-[2-(benzyloxy)-5-(2-bromo-1-hydroxyethyl)phenyl]formamide

6. N-[5-[(1r)-2-bromo-1-hydroxyethyl]-2-(phenylmethoxy)phenyl]formamide

7. Mfcd11053534

8. Schembl274550

9. Dtxsid40456769

10. Lt0055

11. Zinc38298278

12. Ds-15523

13. Cs-0158607

14. 677b590

15. A879799

16. Q-101036

17. (r)-2-bromo-1-(3-formamido-4-benzyloxyphenyl)ethanol

18. N-[2-benzyloxy-5-(2-bromo-1-(r)-hydroxyethyl)phenyl]formamide

19. N-{2-(benzyloxy)-5-[(1r)-2-bromo-1-hydroxyethyl]phenyl}formamide

20. (r)-n-[2-benzyloxy-5-(2-bromo-1-hydroxy-ethyl) -phenyl]-formamide

21. Formamide, N-[5-[(1r)-2-bromo-1-hydroxyethyl]-2-(phenylmethoxy)phenyl]-

2.3 Create Date

2006-10-26

3 Chemical and Physical Properties

Molecular Formula	C₁₆H₁₆BrNO₃
Molecular Weight	350.21 g/mol
XLogP3	2.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	6
Exact Mass	349.03136 g/mol
Monoisotopic Mass	349.03136 g/mol
Topological Polar Surface Area	58.6 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	310
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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201677-59-0

End Use API

Arformoterol Tartrate

About the Company

Hiray Pharma Solutions is an international end-to-end CDMO, facilitating the development and manufacturin...

Hiray Pharma Solutions is an international end-to-end CDMO, facilitating the development and manufacturing of important drug products and key intermediates around the world. We provide the best chemical techniques, control, and manufacturing services to pharmaceutical and innovative enterprises, and a swift path for fine medicine to benefit patients. As an end-to-end CDMO, Hiray can provide on-time, high-quality service for Process R&D, Analytical R&D, Manufacturing, and Quality Control. Hiray operates in strict compliance with, or exceeds, the latest standards for safety, health, and the environment.

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Shouyuan chemical (one of the leading chemicals supplier in China) specializes in manufacturing, supplyin...

Shouyuan chemical (one of the leading chemicals supplier in China) specializes in manufacturing, supplying, and custom synsthesis latest chemicals. Our products cover all kinds of range like pharmaceuticals, agrochemicals, electronic chemicals, surfactants and other specialty chemicals.

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N-[5-bromo-2-(2-nitrophenyl)sulfanyl-phenyl]formamide

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201677-59-0

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Arformoterol Tartrate

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With nearly seven decades of manufacturing expertise, Speichim Processing actively formulates circular ec...

With nearly seven decades of manufacturing expertise, Speichim Processing actively formulates circular economy strategies by reclaiming waste and chemical products across diverse sectors such as fine chemicals, cosmetics, perfumery, pharmaceuticals, and petrochemicals. All our facilities adhere to the Installations Classified for the Protection of the Environment (ICPE) standards and carry Seveso classification, either high threshold (Saint-Vulbas) or low threshold (Beaufort and Mourenx). Committed to continuous enhancement, Speichim Processing complies with the ISO 9001 standard and, for specific products, adheres to the GMP.

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