CAS 54013-18-2 manufacturers and suppliers on PharmaCompass

CAS 54013-18-2

AbbVie CDMO has been working with global companies to develop, manufacture & scale biopharmaceutical products.

Contact Supplier

Cohance Lifesciences, offers full range of CDMO services for small molecule APIs, intermediates, ADCs, Pellets and Formulations.

Contact Supplier

DRL offers a portfolio of products & services, including APIs, CMO services, generics, biosimilars & differentiated formulations.

Contact Supplier

FAMAR CDMO- From early development to commercial manufacturing.

Contact Supplier

evonik-m-2025-09-08

Contact Supplier

Interquim comes from an international group of 50 companies active in the pharma, hospital, diagnostics, fine chemicals & feed sectors.

Contact Supplier

CHEMISTRY

Discover Molecule Insights

Chemistry

Click the arrow to open the dropdown

Click the button for full data set

Click the button for full data set

Also known as: 54013-18-2, 5-chloro-2-(2h-tetrazol-5-yl)aniline, 5-chloro-2-(1h-1,2,3,4-tetrazol-5-yl)aniline, Einecs 258-923-1, 5-(2-amino-4-chlorophenyl)tetrazole, 5-(2-amino-4-chlor-phenyl)-tetrazole

Molecular Formula

C₇H₆ClN₅

Molecular Weight

195.61 g/mol

InChI Key

KKTZHFZXGZLTLZ-UHFFFAOYSA-N

CAS 54013-18-2

1 2D Structure

CAS 54013-18-2

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

5-chloro-2-(2H-tetrazol-5-yl)aniline

2.1.2 InChI

InChI=1S/C7H6ClN5/c8-4-1-2-5(6(9)3-4)7-10-12-13-11-7/h1-3H,9H2,(H,10,11,12,13)

2.1.3 InChI Key

KKTZHFZXGZLTLZ-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1=CC(=C(C=C1Cl)N)C2=NNN=N2

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 54013-18-2

2. 5-chloro-2-(2h-tetrazol-5-yl)aniline

3. 5-chloro-2-(1h-1,2,3,4-tetrazol-5-yl)aniline

4. Einecs 258-923-1

5. 5-(2-amino-4-chlorophenyl)tetrazole

6. 5-(2-amino-4-chlor-phenyl)-tetrazole

7. 5-(2-amino-4-chlorophenyl)-1h-tetrazole

8. Chembl451378

9. Schembl1308358

10. Dtxsid40202329

11. Mfcd03085917

12. Akos013153469

13. Ps-3801

14. 5-chloro-2-(1h-tetrazol-5-yl)-phenylamine

15. Cs-0246694

16. Ns00032918

17. En300-338553

18. Z1251218476

2.3 Create Date

2005-07-08

3 Chemical and Physical Properties

Molecular Formula	C₇H₆ClN₅
Molecular Weight	195.61 g/mol
XLogP3	1.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	80.5
Heavy Atom Count	13
Formal Charge	0
Complexity	178
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

Market Place

Home

Menu

Post Enquiry

Market Place

Search