5,7-Dichlorobenzoxazole-2-methanamine - CAS 1267345-98-1
Catalog: |
BB006647 |
Product Name: |
5,7-Dichlorobenzoxazole-2-methanamine |
CAS: |
1267345-98-1 |
Synonyms: |
(5,7-dichloro-1,3-benzoxazol-2-yl)methanamine; (5,7-dichloro-1,3-benzoxazol-2-yl)methanamine |
IUPAC Name: | (5,7-dichloro-1,3-benzoxazol-2-yl)methanamine |
Description: | 5,7-Dichlorobenzoxazole-2-methanamine (CAS# 1267345-98-1 ) is a useful research chemical. |
Molecular Weight: | 217.05 |
Molecular Formula: | C8H6Cl2N2O |
Canonical SMILES: | C1=C(C=C2C(=C1Cl)OC(=N2)CN)Cl |
InChI: | InChI=1S/C8H6Cl2N2O/c9-4-1-5(10)8-6(2-4)12-7(3-11)13-8/h1-2H,3,11H2 |
InChI Key: | PYKXHIALRDSNTC-UHFFFAOYSA-N |
Complexity: | 193 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 215.9857182 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 215.9857182 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 52 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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Related Functional Groups
Benzoxazole/Benzothiazole
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