2-Chloro-6-fluoro-3-methylaniline - CAS 886501-03-7
Catalog: |
BB070351 |
Product Name: |
2-Chloro-6-fluoro-3-methylaniline |
CAS: |
886501-03-7 |
Synonyms: |
2-Chloro-6-fluoro-3-methylaniline; 2-Chloro-6-fluoro-3-methylbenzenamine; 2-chloro-6-fluoro-3-methyl-phenylamine |
IUPAC Name: | 2-chloro-6-fluoro-3-methylaniline |
Description: | 2-Chloro-6-fluoro-3-methylaniline |
Molecular Weight: | 159.59 |
Molecular Formula: | C7H7ClFN |
Canonical SMILES: | CC1=C(C(=C(C=C1)F)N)Cl |
InChI: | InChI=1S/C7H7ClFN/c1-4-2-3-5(9)7(10)6(4)8/h2-3H,10H2,1H3 |
InChI Key: | ZEDOBEHSBNTVKR-UHFFFAOYSA-N |
Complexity: | 120 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 159.0251051 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 159.0251051 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 26Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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