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CAS 73771-08-1 manufacturers and suppliers on PharmaCompass

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CAS 73771-08-1
Also known as: 73771-08-1, 4-nitro-n-trichloromethylthiophthalimide, Dtxsid10224139
Molecular Formula
C9H3Cl3N2O4S
Molecular Weight
341.6  g/mol
InChI Key
RCPLHWOKWNLFBE-UHFFFAOYSA-N

1 2D Structure

CAS 73771-08-1

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
4-nitro-2-(trichloromethylsulfanyl)isoindole-1,3-dione
2.1.2 InChI
InChI=1S/C9H3Cl3N2O4S/c10-9(11,12)19-13-7(15)4-2-1-3-5(14(17)18)6(4)8(13)16/h1-3H
2.1.3 InChI Key
RCPLHWOKWNLFBE-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)N(C2=O)SC(Cl)(Cl)Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 73771-08-1

2. 4-nitro-n-trichloromethylthiophthalimide

3. Dtxsid10224139

2.3 Create Date
2005-08-09
3 Chemical and Physical Properties
Molecular Weight 341.6 g/mol
Molecular Formula C9H3Cl3N2O4S
XLogP33.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass g/mol
Monoisotopic Mass g/mol
Topological Polar Surface Area109
Heavy Atom Count19
Formal Charge0
Complexity436
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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Digital Content Digital Content
URL Supplier Web Content
5407-04-5
Citalopram
Maisuriya Pharma Solutions is a research-driven & technology-oriented company. Continuous innovations & i...
Maisuriya Pharma Solutions is a research-driven & technology-oriented company. Continuous innovations & improvement are the lifeblood of our business. Our major focus is to offer pharmaceutical solutions globally. Our core expertise: Development of processes and production of complex molecules for Lifesciences and Specialty Chemicals markets. We are committed to providing customers with products fulfilling customers’ needs and expectations. Maisuriya Pharma Solutions ensures Safety and Reliability with respect to regulations (sustainable development, ISO, GMP), and guarantees total confidentiality.
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