| CAS Number | 1269232-95-2 |
| Catalog Number | AG000THH(AGN-PC-0WCXWV) |
| Chemical Name | Benzenamine, 3-bromo-5-chloro-2-fluoro- |
| IUPAC Name | 3-bromo-5-chloro-2-fluoroaniline |
| InChI | InChI=1S/C6H4BrClFN/c7-4-1-3(8)2-5(10)6(4)9/h1-2H,10H2 |
| InChI Key | CSHMFIIPOVGVDN-UHFFFAOYSA-N |
| MDL Number | MFCD19382423 |
| Molecular Formula | C6H4BrClFN |
| Molecular Weight | 224.4581 |
| SMILES | NC1=CC(Cl)=CC(Br)=C1F |
| Synonyms | 3-BROMO-5-CHLORO-2-FLUOROANILINE,
1269232-95-2,
SCHEMBL1494602,
DTXSID90679587,
CSHMFIIPOVGVDN-UHFFFAOYSA-N,
MFCD19382423,
ZINC66054998,
AKOS023126486,
FCH1357431,
Benzenamine,3-bromo-5-chloro-2-fluoro-,
AS-36091,
Benzenamine, 3-bromo-5-chloro-2-fluoro-,
AB0074216,
AX8266597,
X-2137,
3-Bromo-5-chloro-2-fluorobenzenamine,
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| Complexity | 124 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 222.92g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 224.457g/mol |
| Monoisotopic Mass | 222.92g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P330-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
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UN Code
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Certificate of Analysis
Lot Number