N-Benzyl-N-(2-quinolinylmethyl)formamide - CAS 849798-00-1
Catalog: |
BB037389 |
Product Name: |
N-Benzyl-N-(2-quinolinylmethyl)formamide |
CAS: |
849798-00-1 |
Synonyms: |
N-benzyl-N-(quinolin-2-ylmethyl)formamide |
IUPAC Name: | N-benzyl-N-(quinolin-2-ylmethyl)formamide |
Description: | N-Benzyl-N-(2-quinolinylmethyl)formamide (CAS# 849798-00-1 ) is a useful research chemical. |
Molecular Weight: | 276.33 |
Molecular Formula: | C18H16N2O |
Canonical SMILES: | C1=CC=C(C=C1)CN(CC2=NC3=CC=CC=C3C=C2)C=O |
InChI: | InChI=1S/C18H16N2O/c21-14-20(12-15-6-2-1-3-7-15)13-17-11-10-16-8-4-5-9-18(16)19-17/h1-11,14H,12-13H2 |
InChI Key: | UCIKFROUISXGMV-UHFFFAOYSA-N |
Boiling Point: | 508.4 °C at 760 mmHg |
Density: | 1.194 g/cm3 |
LogP: | 4.02930 |
GHS Hazard Statement: | H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard] |
Precautionary Statement: | P273, P391, and P501 |
Signal Word: | Warning |
Complexity: | 327 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 276.126263138 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 276.126263138 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 33.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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