Kimia Biosciences

CAS 1019453-85-0

Chemistry, 1 End Use API, 8 Related Intermediates

Manufacturers/Suppliers

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Also known as: 1019453-85-0, 2-[(2,4-dimethylphenyl)sulfanyl]aniline, 2-(2,4-dimethylphenyl)sulfanylaniline, 2-((2,4-dimethylphenyl)thio)phenylamine, 2-(2,4-dimethylphenylthio)benzenamine, Benzenamine, 2-[(2,4-dimethylphenyl)thio]-

Molecular Formula

C₁₄H₁₅NS

Molecular Weight

229.34 g/mol

InChI Key

BJHMYQKFVFJZDC-UHFFFAOYSA-N

1 2D Structure

CAS 1019453-85-0

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-(2,4-dimethylphenyl)sulfanylaniline

2.1.2 InChI

InChI=1S/C14H15NS/c1-10-7-8-13(11(2)9-10)16-14-6-4-3-5-12(14)15/h3-9H,15H2,1-2H3

2.1.3 InChI Key

BJHMYQKFVFJZDC-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CC1=CC(=C(C=C1)SC2=CC=CC=C2N)C

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 1019453-85-0

2. 2-[(2,4-dimethylphenyl)sulfanyl]aniline

3. 2-(2,4-dimethylphenyl)sulfanylaniline

4. 2-((2,4-dimethylphenyl)thio)phenylamine

5. 2-(2,4-dimethylphenylthio)benzenamine

6. Benzenamine, 2-[(2,4-dimethylphenyl)thio]-

7. Schembl14723181

8. Dtxsid10651401

9. 2-(2,4-dimethylphenylthio)aniline

10. Mfcd11132336

11. Akos000215256

12. Ds-12247

13. Cs-0153314

14. Ft-0700813

15. J3.556.218d

16. En300-6497671

17. A910226

18. Z330803132

2.3 Create Date

2009-05-28

3 Chemical and Physical Properties

Molecular Formula	C₁₄H₁₅NS
Molecular Weight	229.34 g/mol
XLogP3	4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	51.3
Heavy Atom Count	16
Formal Charge	0
Complexity	219
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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2,4-dimethylbenzenethiol

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CAS Number

13616-82-5

End Use API

Vortioxetine Hydrobromide

About the Company

Kimia Biosciences, established in 1993, is focused on manufacturing bulk drugs for various therapeutic se...

Kimia Biosciences, established in 1993, is focused on manufacturing bulk drugs for various therapeutic segments. With a strong emphasis on excellence and advanced technologies, Kimia aims to become a globally recognized company in both APIs and FDFs while upholding clean business practices. Kimia's state-of-the-art facilities at Village Bhondsi, Gurugram enable it to produce a wide range of APIs. Kimia also plans to establish its own facilities for lifestyle segments, adhering to international regulatory standards. Kimia aims to provide the best pharmaceutical products and support to consumers and healthcare professionals.

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