N-Methyl 4-bromo-2-chlorobenzamide - CAS 893420-23-0
Catalog: |
BB059849 |
Product Name: |
N-Methyl 4-bromo-2-chlorobenzamide |
CAS: |
893420-23-0 |
Synonyms: |
4-Bromo-2-chloro-N-methylbenzamide; N-Methyl 4-bromo-2-chlorobenzamide; 4-Bromo-2-chloro-N-methyl-benzamide |
IUPAC Name: | 4-bromo-2-chloro-N-methylbenzamide |
Description: | N-Methyl 4-bromo-2-chlorobenzamide |
Molecular Weight: | 248.5 |
Molecular Formula: | C8H7BrClNO |
Canonical SMILES: | CNC(=O)C1=C(C=C(C=C1)Br)Cl |
InChI: | InChI=1S/C8H7BrClNO/c1-11-8(12)6-3-2-5(9)4-7(6)10/h2-4H,1H3,(H,11,12) |
InChI Key: | UFLXVXIDMCMCCF-UHFFFAOYSA-N |
Complexity: | 176 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 246.93995 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 246.93995 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 29.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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