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Also known as: 872509-56-3, Mfcd21648506, 2,6-dichloro-3,5-dimethoxybenzenamine, Benzenamine, 2,6-dichloro-3,5-dimethoxy-, Schembl159064, Amy16775
Molecular Formula
C8H9Cl2NO2
Molecular Weight
222.07  g/mol
InChI Key
LCQFHEIDCMPNAN-UHFFFAOYSA-N

CAS 872509-56-3
1 2D Structure

CAS 872509-56-3

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2,6-dichloro-3,5-dimethoxyaniline
2.1.2 InChI
InChI=1S/C8H9Cl2NO2/c1-12-4-3-5(13-2)7(10)8(11)6(4)9/h3H,11H2,1-2H3
2.1.3 InChI Key
LCQFHEIDCMPNAN-UHFFFAOYSA-N
2.1.4 Canonical SMILES
COC1=CC(=C(C(=C1Cl)N)Cl)OC
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 872509-56-3

2. Mfcd21648506

3. 2,6-dichloro-3,5-dimethoxybenzenamine

4. Benzenamine, 2,6-dichloro-3,5-dimethoxy-

5. Schembl159064

6. Amy16775

7. Bcp20519

8. Cs-b0775

9. Xjb50956

10. 2,6-dichloro-3,5-dimethoxy-anilin

11. Zinc94568764

12. 2,6-dichloro-3,5-dimethoxy-aniline

13. Akos017343640

14. Ds-7465

15. Sb23249

16. 2,6-dichloro-3,5-dimethoxy-phenylamine

17. Sy105511

18. A862701

2.3 Create Date
2012-08-20
3 Chemical and Physical Properties
Molecular Weight 222.07 g/mol
Molecular Formula C8H9Cl2NO2
XLogP32.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass221.0010339 g/mol
Monoisotopic Mass221.0010339 g/mol
Topological Polar Surface Area44.5 Ų
Heavy Atom Count13
Formal Charge0
Complexity154
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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The Pharmacy Technology
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Virtual BoothJinan Tantu Chemicals offers customized R&D services & production of small molecule APIs & pharmaceutical intermediates.

2,6-Dichloro-3,5-dimethoxyaniline

CAS Number : 872509-56-3

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About the Company : Jinan Tantu Chemicals Co., Ltd. operates as a Contract Development and Manufacturing Organization (CDMO) that serves pharmaceutical companies worldwide. Our core services include custom...

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2,6-dichloro-3,5-dimethoxyaniline

CAS Number : 872509-56-3

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About the Company : Established in August 2011, Raffles PharmaTech is a high-tech enterprise that focus on development, manufacturing and sales of high-value added active pharmaceutical ingredients and int...

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2,6-dichloro-3,5-dimethoxyaniline

CAS Number : 872509-56-3

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About the Company : Prajna is an innovation driven pharmaceutical company. We dedicated to Research, Process development and Manufacturing APIs and Advanced Intermediates for Active Pharmaceutical Ingredie...

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