| CAS Number | 58416-31-2 |
| Catalog Number | AG00ELT2(AGN-PC-0JOD3G) |
| Chemical Name | 7-chloro-6-nitroquinoline |
| IUPAC Name | 7-chloro-6-nitroquinoline |
| InChI | InChI=1S/C9H5ClN2O2/c10-7-5-8-6(2-1-3-11-8)4-9(7)12(13)14/h1-5H |
| InChI Key | PKJPESBDOWOQAI-UHFFFAOYSA-N |
| MDL Number | MFCD18448459 |
| Molecular Formula | C9H5ClN2O2 |
| Molecular Weight | 208.6012 |
| NSC Number | 39970 |
| SMILES | O=[N+](C1=C(Cl)C=C2N=CC=CC2=C1)[O-] |
| Synonyms | 7-chloro-6-nitroquinoline,
58416-31-2,
7-chloro-6-nitro-quinoline,
NSC39970,
AC1L5XOL,
AC1Q1YES,
SCHEMBL358934,
Quinoline, 7-chloro-6-nitro-,
CTK1H3832,
DTXSID00284964,
PKJPESBDOWOQAI-UHFFFAOYSA-N,
ZINC1671643,
MFCD18448459,
NSC-39970,
AKOS027325533,
AS-47072,
CS-0039510,
AR-1H3373,
CID236924,
64917-82-4,
|
| Complexity | 231 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 208.004g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 208.601g/mol |
| Monoisotopic Mass | 208.004g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 58.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
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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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number