3-Amino-4-fluorobenzaldehyde - CAS 1005507-27-6
Catalog: |
BB074779 |
Product Name: |
3-Amino-4-fluorobenzaldehyde |
CAS: |
1005507-27-6 |
Synonyms: |
3-amino-4-fluorobenzaldehyde |
IUPAC Name: | 3-amino-4-fluorobenzaldehyde |
Molecular Weight: | 139.13 |
Molecular Formula: | C7H6FNO |
Canonical SMILES: | C1=CC(=C(C=C1C=O)N)F |
InChI: | InChI=1S/C7H6FNO/c8-6-2-1-5(4-10)3-7(6)9/h1-4H,9H2 |
InChI Key: | HKMDGMKHHDLUMH-UHFFFAOYSA-N |
Complexity: | 129 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 139.043341977 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 139.043341977 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 43.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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