1-(2-pyrrolidinylmethyl)-1H-pyrazole - CAS 1171334-97-6
Catalog: |
BB053520 |
Product Name: |
1-(2-pyrrolidinylmethyl)-1H-pyrazole |
CAS: |
1171334-97-6 |
Synonyms: |
1-(2-pyrrolidinylmethyl)-1H-pyrazole; 1-[(Pyrrolidin-2-yl)methyl]-1H-pyrazole; (pyrrolidin-2-ylmethyl)pyrazole |
IUPAC Name: | 1-(pyrrolidin-2-ylmethyl)pyrazole |
Molecular Weight: | 151.21 |
Molecular Formula: | C8H13N3 |
Canonical SMILES: | C1CC(NC1)CN2C=CC=N2 |
InChI: | InChI=1S/C8H13N3/c1-3-8(9-4-1)7-11-6-2-5-10-11/h2,5-6,8-9H,1,3-4,7H2 |
InChI Key: | NROSSDZFPHQESU-UHFFFAOYSA-N |
Boiling Point: | 262.2±13.0 °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]; H318 (100%): Causes serious eye damage [Danger 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+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Danger |
Complexity: | 127 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 151.110947427 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 151.110947427 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 29.8 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.3 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Pyrazoles
Pyrrolidines
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS