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Chemistry

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Also known as: Mephenate, 2620-53-3, (4-chlorophenyl) n-methylcarbamate, W66v2205iu, Carbamic acid,n-methyl-, 4-chlorophenyl ester, P-chlorophenyl methylcarbamate
Molecular Formula
C8H8ClNO2
Molecular Weight
185.61  g/mol
InChI Key
WMMQJAQJAPXWDO-UHFFFAOYSA-N
FDA UNII
W66V2205IU

Mephenate
1 2D Structure

Mephenate

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(4-chlorophenyl) N-methylcarbamate
2.1.2 InChI
InChI=1S/C8H8ClNO2/c1-10-8(11)12-7-4-2-6(9)3-5-7/h2-5H,1H3,(H,10,11)
2.1.3 InChI Key
WMMQJAQJAPXWDO-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CNC(=O)OC1=CC=C(C=C1)Cl
2.2 Other Identifiers
2.2.1 UNII
W66V2205IU
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 4-chlorophenyl-n-methylcarbamate

2. P-chlorophenyl-n-methylcarbamate

2.3.2 Depositor-Supplied Synonyms

1. Mephenate

2. 2620-53-3

3. (4-chlorophenyl) N-methylcarbamate

4. W66v2205iu

5. Carbamic Acid,n-methyl-, 4-chlorophenyl Ester

6. P-chlorophenyl Methylcarbamate

7. 4-chlorophenyl-n-methylcarbamate

8. Ppg 124

9. Drc 3343

10. Brn 2047297

11. Unii-w66v2205iu

12. Carbamic Acid, Methyl-, P-chlorophenyl Ester

13. 4-chlorophenyl N-methylcarbamate

14. Carbamic Acid, Methyl-, 4-chlorophenyl Ester

15. 4-06-00-00843 (beilstein Handbook Reference)

16. Schembl188010

17. P-chlorophenyl N-methylcarbamate

18. P-chlorophenyl-n-methylcarbamate

19. Dtxsid0041511

20. (4-chlorophenyl)n-methylcarbamate

21. Zinc2035998

22. Ae-641/05046030

23. Q3333247

2.4 Create Date
2005-08-08
3 Chemical and Physical Properties
Molecular Weight 185.61 g/mol
Molecular Formula C8H8ClNO2
XLogP32
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass185.0243562 g/mol
Monoisotopic Mass185.0243562 g/mol
Topological Polar Surface Area38.3 Ų
Heavy Atom Count12
Formal Charge0
Complexity155
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

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