N,N-Dimethyl-1H-pyrazole-4-carboxamide - CAS 91918-13-7
Catalog: |
BB051679 |
Product Name: |
N,N-Dimethyl-1H-pyrazole-4-carboxamide |
CAS: |
91918-13-7 |
Synonyms: |
1H-Pyrazole-4-carboxamide, N,N-dimethyl- |
IUPAC Name: | N,N-dimethyl-1H-pyrazole-4-carboxamide |
Molecular Weight: | 139.16 |
Molecular Formula: | C6H9N3O |
Canonical SMILES: | CN(C)C(=O)C1=CNN=C1 |
InChI: | InChI=1S/C6H9N3O/c1-9(2)6(10)5-3-7-8-4-5/h3-4H,1-2H3,(H,7,8) |
InChI Key: | XHOFWFVNVHZGMB-UHFFFAOYSA-N |
Boiling Point: | 346.2±15.0 °C at 760 mmHg |
Purity: | >95% |
Density: | 1.2±0.1 g/cm3 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 135 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 139.074561919 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 139.074561919 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 49 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.3 |
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Related Functional Groups
Carbonyl Compounds
Nitrogen Compounds
Oxygen Compounds
Pyrazoles
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