4-Fluoro-1-n-propylbenzene-1,2-diamine - CAS 300798-95-2
Catalog: |
BB065101 |
Product Name: |
4-Fluoro-1-n-propylbenzene-1,2-diamine |
CAS: |
300798-95-2 |
Synonyms: |
4-fluoro-1-N-propylbenzene-1,2-diamine; 4-fluoro-N1-propylbenzene-1,2-diamine |
IUPAC Name: | 4-fluoro-1-N-propylbenzene-1,2-diamine |
Description: | 4-Fluoro-1-n-propylbenzene-1,2-diamine |
Molecular Weight: | 168.21 |
Molecular Formula: | C9H13FN2 |
Canonical SMILES: | CCCNC1=C(C=C(C=C1)F)N |
InChI: | InChI=1S/C9H13FN2/c1-2-5-12-9-4-3-7(10)6-8(9)11/h3-4,6,12H,2,5,11H2,1H3 |
InChI Key: | ZRKLXAJXEPZWCU-UHFFFAOYSA-N |
Complexity: | 130 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 168.10627659 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 168.10627659 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 38Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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