CAS 18595-12-5

Chemistry

Chemistry

Manufacturers/Suppliers

1 Suppliers

1 Suppliers

Also known as: 18595-12-5, 5-amino-2-methyl-benzoic acid methyl ester, 5-amino-2-methylbenzoic acid methyl ester, Methyl5-amino-2-methylbenzoate, Benzoic acid, 5-amino-2-methyl-, methyl ester, Mfcd08752568

Molecular Formula

C₉H₁₁NO₂

Molecular Weight

165.19 g/mol

InChI Key

JNPZKGOLYSCSEL-UHFFFAOYSA-N

1 2D Structure

CAS 18595-12-5

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

methyl 5-amino-2-methylbenzoate

2.1.2 InChI

InChI=1S/C9H11NO2/c1-6-3-4-7(10)5-8(6)9(11)12-2/h3-5H,10H2,1-2H3

2.1.3 InChI Key

JNPZKGOLYSCSEL-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CC1=C(C=C(C=C1)N)C(=O)OC

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 18595-12-5

2. 5-amino-2-methyl-benzoic Acid Methyl Ester

3. 5-amino-2-methylbenzoic Acid Methyl Ester

4. Methyl5-amino-2-methylbenzoate

5. Benzoic Acid, 5-amino-2-methyl-, Methyl Ester

6. Mfcd08752568

7. 5-amino-2-methyl Benzoic Acid Methyl Ester

8. Methyl 5-amino-o-toluate

9. Benzoic Acid,5-amino-2-methyl-, Methyl Ester

10. Schembl1321845

11. Methyl 2-methyl-5-aminobenzoate

12. Methyl 3-amino-6-methylbenzoate

13. Dtxsid30567555

14. 3-amino-6-methyl Benzoate

15. Amy36355

16. Bcp24565

17. 5-amino-o-toluic Acid Methyl Ester

18. Zinc21299179

19. Akos005259440

20. Ac-5047

21. Cs-w003565

22. Sb34629

23. As-12564

24. Sy021381

25. 2-methyl-5-aminobenzoic Acid Methyl Ester

26. Ft-0647669

27. M2540

28. W-201669

29. Z1318516265

2.3 Create Date

2007-02-09

3 Chemical and Physical Properties

Molecular Formula	C₉H₁₁NO₂
Molecular Weight	165.19 g/mol
XLogP3	2.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	165.078978594 g/mol
Monoisotopic Mass	165.078978594 g/mol
Topological Polar Surface Area	52.3 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	170
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

List of Suppliers

Full Screen View

Reset Filter

Ask Us

Shouyuan Chemical

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

Post an Enquiry

China

Virtual Booth

Digital Content

Methyl 5-Amino-2-Methylbenzoate

PDF Supplier PDF

URL Supplier Web Content

CAS Number

18595-12-5

End Use API

About the Company

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.

ASK
US