4-Bromo-N-isopropylnaphthalene-1-carboxamide - CAS 1381944-77-9
Catalog: |
BB055345 |
Product Name: |
4-Bromo-N-isopropylnaphthalene-1-carboxamide |
CAS: |
1381944-77-9 |
Synonyms: |
4-Bromo-N-isopropylnaphthalene-1-carboxamide; 4-bromo-N-propan-2-ylnaphthalene-1-carboxamide |
IUPAC Name: | 4-bromo-N-propan-2-ylnaphthalene-1-carboxamide |
Description: | 4-Bromo-N-isopropylnaphthalene-1-carboxamide |
Molecular Weight: | 292.17 |
Molecular Formula: | C14H14BrNO |
Canonical SMILES: | CC(C)NC(=O)C1=CC=C(C2=CC=CC=C21)Br |
InChI: | InChI=1S/C14H14BrNO/c1-9(2)16-14(17)12-7-8-13(15)11-6-4-3-5-10(11)12/h3-9H,1-2H3,(H,16,17) |
InChI Key: | UIKDFYLOBJKGHT-UHFFFAOYSA-N |
Complexity: | 279 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 291.02588 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 291.02588 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 29.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.9 |
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