2-Amino-6-methylbenzonitrile - CAS 56043-01-7
Catalog: |
BB029241 |
Product Name: |
2-Amino-6-methylbenzonitrile |
CAS: |
56043-01-7 |
Synonyms: |
2-amino-6-methylbenzonitrile |
IUPAC Name: | 2-amino-6-methylbenzonitrile |
Description: | 2-Amino-6-methylbenzonitrile (CAS# 56043-01-7) is a useful research chemical. |
Molecular Weight: | 132.16 |
Molecular Formula: | C8H8N2 |
Canonical SMILES: | CC1=C(C(=CC=C1)N)C#N |
InChI: | InChI=1S/C8H8N2/c1-6-3-2-4-8(10)7(6)5-9/h2-4H,10H2,1H3 |
InChI Key: | PKOMYWHVCYHAHW-UHFFFAOYSA-N |
Boiling Point: | 287.6 °C at 760 mmHg |
Melting Point: | 127-132 °C |
Purity: | 95 % |
Density: | 1.1 g/cm3 |
Appearance: | Dark brown crystaline |
MDL: | MFCD00058686 |
LogP: | 2.03008 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021078995-A1 | Selective polypeptide synthesis stalling assay and compound | 20191025 |
WO-2021028382-A1 | [1,2,4]triazolo[1,5-c]quinazolin-5-amines | 20190812 |
CN-109879820-A | A kind of synthetic method of quinazolinone heterocyclic compound | 20190226 |
DE-102018201548-A1 | Electrolytic composition for electrochemical cell for high temperature applications | 20180201 |
WO-2019149812-A1 | Electrolyte composition for electrochemical cell for high-temperature applications | 20180201 |
Complexity: | 156 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 132.068748264 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 132.068748264 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 49.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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