2-Amino-6-bromo-1,2,3,4-tetrahydronaphthalene-2-carboxylic Acid Hydrochloride - CAS 1461714-77-1
Catalog: |
BB075042 |
Product Name: |
2-Amino-6-bromo-1,2,3,4-tetrahydronaphthalene-2-carboxylic Acid Hydrochloride |
CAS: |
1461714-77-1 |
Synonyms: |
2-amino-6-bromo-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid hydrochloride; 2-amino-6-bromo-3,4-dihydro-1H-naphthalene-2-carboxylic acid; hydrochloride; 2-amino-6-bromo-1,2,3,4-tetrahydronaphthalene-2-carboxylicacidhydrochloride |
IUPAC Name: | 2-amino-6-bromo-3,4-dihydro-1H-naphthalene-2-carboxylic acidhydrochloride |
Molecular Weight: | 306.58 |
Molecular Formula: | C11H12NO2Br·HCl |
Canonical SMILES: | C1CC(CC2=C1C=C(C=C2)Br)(C(=O)O)N.Cl |
InChI: | InChI=1S/C11H12BrNO2.ClH/c12-9-2-1-8-6-11(13,10(14)15)4-3-7(8)5-9/h1-2,5H,3-4,6,13H2,(H,14,15)1H |
InChI Key: | PRFXJDFWAMKKLB-UHFFFAOYSA-N |
Complexity: | 271 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 304.98182 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 304.98182 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 63.3Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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