1-Benzyl-3-(hydroxymethyl)piperazine - CAS 85817-34-1
Catalog: |
BB046646 |
Product Name: |
1-Benzyl-3-(hydroxymethyl)piperazine |
CAS: |
85817-34-1 |
Synonyms: |
4-N-benzyl-2-hydroxymethylpiperazine; (4-Benzyl-piperazin-2-yl)-methanol; 4-(phenylmethyl)-2-piperazinemethanol |
IUPAC Name: | (4-benzylpiperazin-2-yl)methanol |
Description: | 1-Benzyl-3-(hydroxymethyl)piperazine (CAS# 85817-34-1 ) is a useful research chemical. |
Molecular Weight: | 206.28 |
Molecular Formula: | C12H18N2O |
Canonical SMILES: | C1CN(CC(N1)CO)CC2=CC=CC=C2 |
InChI: | InChI=1S/C12H18N2O/c15-10-12-9-14(7-6-13-12)8-11-4-2-1-3-5-11/h1-5,12-13,15H,6-10H2 |
InChI Key: | PJMFGDYBTJEEDP-UHFFFAOYSA-N |
Boiling Point: | 318.1±32.0 °C (Predicted) |
Purity: | 98 % |
Density: | 1.083±0.06 g/cm3 (Predicted) |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 181 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 206.141913202 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 206.141913202 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 35.5 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.5 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Alcohols and Derivatives
Piperazines
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS