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CAS 610-41-3 manufacturers and suppliers on PharmaCompass

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  • Chemistry
4CH-016590
Also known as: 610-41-3, Benzenamine, 3,4-dinitro-, Schembl1254184, Dtxsid40209858, Zinc5161708, Mfcd00456811
Molecular Formula
C6H5N3O4
Molecular Weight
183.12  g/mol
InChI Key
IPZPZSUDOPUDPM-UHFFFAOYSA-N

1 2D Structure

4CH-016590

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
3,4-dinitroaniline
2.1.2 InChI
InChI=1S/C6H5N3O4/c7-4-1-2-5(8(10)11)6(3-4)9(12)13/h1-3H,7H2
2.1.3 InChI Key
IPZPZSUDOPUDPM-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC(=C(C=C1N)[N+](=O)[O-])[N+](=O)[O-]
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 610-41-3

2. Benzenamine, 3,4-dinitro-

3. Schembl1254184

4. Dtxsid40209858

5. Zinc5161708

6. Mfcd00456811

7. Akos015916305

8. Akos016007696

9. Ps-6135

10. Db-053778

11. Cs-0204251

12. Ft-0632543

13. A22410

14. Ae-848/34529004

2.3 Create Date
2005-03-27
3 Chemical and Physical Properties
Molecular Weight 183.12 g/mol
Molecular Formula C6H5N3O4
XLogP30.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count0
Exact Mass183.02800565 g/mol
Monoisotopic Mass183.02800565 g/mol
Topological Polar Surface Area118 Ų
Heavy Atom Count13
Formal Charge0
Complexity221
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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610-41-3
MAITHILI is a group of companies based in India (MAM, MLS, MAC, MAT,SGG) and Singapore(MITCO). Maithili ...
MAITHILI is a group of companies based in India (MAM, MLS, MAC, MAT,SGG) and Singapore(MITCO). Maithili Life Sciences (MLS) is a Contract Research Organization headquartered in Hyderabad(lab scale). API operations are supported by a manufacturing unit with cGMP facility designed in accordance with international standards with a built up space of around 4,35,600 sq ft located in Tirupati,AP,India(pilot scale).
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610-41-3
MAITHILI is a group of companies based in India (MAM, MLS, MAC, MAT,SGG) and Singapore(MITCO). Maithili ...
MAITHILI is a group of companies based in India (MAM, MLS, MAC, MAT,SGG) and Singapore(MITCO). Maithili Life Sciences (MLS) is a Contract Research Organization headquartered in Hyderabad(lab scale). API operations are supported by a manufacturing unit with cGMP facility designed in accordance with international standards with a built up space of around 4,35,600 sq ft located in Tirupati,AP,India(pilot scale).
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