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CAS 37763-23-8 manufacturers and suppliers on PharmaCompass

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CAS 37763-23-8
Also known as: 37763-23-8, Methyl d-(-)-4-hydroxy-phenylglycinate, Methyl (2r)-2-amino-2-(4-hydroxyphenyl)acetate, Methyl d-(-)-4-hydroxyphenylglycinate, Schembl1143624, 37763-23-8 (free base)
Molecular Formula
C9H11NO3
Molecular Weight
181.19  g/mol
InChI Key
SZBDOFWNZVHVGR-MRVPVSSYSA-N

1 2D Structure

CAS 37763-23-8

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
methyl (2R)-2-amino-2-(4-hydroxyphenyl)acetate
2.1.2 InChI
InChI=1S/C9H11NO3/c1-13-9(12)8(10)6-2-4-7(11)5-3-6/h2-5,8,11H,10H2,1H3/t8-/m1/s1
2.1.3 InChI Key
SZBDOFWNZVHVGR-MRVPVSSYSA-N
2.1.4 Canonical SMILES
COC(=O)C(C1=CC=C(C=C1)O)N
2.1.5 Isomeric SMILES
COC(=O)[C@@H](C1=CC=C(C=C1)O)N
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 37763-23-8

2. Methyl D-(-)-4-hydroxy-phenylglycinate

3. Methyl (2r)-2-amino-2-(4-hydroxyphenyl)acetate

4. Methyl D-(-)-4-hydroxyphenylglycinate

5. Schembl1143624

6. 37763-23-8 (free Base)

7. Mfcd07778088

8. Zinc21992735

9. Akos015920010

10. Cs-w021142

11. As-13487

12. (r)-methyl2-amino-2-(4-hydroxyphenyl)acetate

13. Methyl (r)-2-amino-2-(4-hydroxyphenyl)acetate

14. 763m238

15. Benzeneacetic Acid, A-amino-4-hydroxy-, Methyl Ester, (ar)-

2.3 Create Date
2006-10-26
3 Chemical and Physical Properties
Molecular Weight 181.19 g/mol
Molecular Formula C9H11NO3
XLogP30.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass181.07389321 g/mol
Monoisotopic Mass181.07389321 g/mol
Topological Polar Surface Area72.6 Ų
Heavy Atom Count13
Formal Charge0
Complexity176
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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