8-Chloro-3,4-dihydro-2H-1,4-benzoxazine - CAS 939759-05-4
Catalog: |
BB041146 |
Product Name: |
8-Chloro-3,4-dihydro-2H-1,4-benzoxazine |
CAS: |
939759-05-4 |
Synonyms: |
8-chloro-3,4-dihydro-2H-1,4-benzoxazine; 8-chloro-3,4-dihydro-2H-1,4-benzoxazine |
IUPAC Name: | 8-chloro-3,4-dihydro-2H-1,4-benzoxazine |
Description: | 8-Chloro-3,4-dihydro-2H-1,4-benzoxazine (CAS# 939759-05-4 ) is a useful research chemical. |
Molecular Weight: | 169.61 |
Molecular Formula: | C8H8ClNO |
Canonical SMILES: | C1COC2=C(N1)C=CC=C2Cl |
InChI: | InChI=1S/C8H8ClNO/c9-6-2-1-3-7-8(6)11-5-4-10-7/h1-3,10H,4-5H2 |
InChI Key: | BMCXOTDTJQCKIU-UHFFFAOYSA-N |
LogP: | 2.28230 |
Complexity: | 142 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 169.0294416 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 169.0294416 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 21.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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