2-(1,2,4-Triazol-1-yl)benzylamine - CAS 449756-97-2

Catalog:	BB025737
Product Name:	2-(1,2,4-Triazol-1-yl)benzylamine
CAS:	449756-97-2
Synonyms:	[2-(1,2,4-triazol-1-yl)phenyl]methanamine; [2-(1,2,4-triazol-1-yl)phenyl]methanamine

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	[2-(1,2,4-triazol-1-yl)phenyl]methanamine
Description:	2-(1,2,4-Triazol-1-yl)benzylamine (CAS# 449756-97-2) is a useful research chemical.
Molecular Weight:	174.20
Molecular Formula:	C9H10N4
Canonical SMILES:	C1=CC=C(C(=C1)CN)N2C=NC=N2
InChI:	InChI=1S/C9H10N4/c10-5-8-3-1-2-4-9(8)13-7-11-6-12-13/h1-4,6-7H,5,10H2
InChI Key:	NIIBEJVCPXCXBQ-UHFFFAOYSA-N
Boiling Point:	375.9 °C at 760 mmHg
Density:	1.26 g/cm³
MDL:	MFCD12027080
LogP:	1.42630

Publication Number	Title	Priority Date
EP-2634190-A1	Pyrazolo-triazine derivatives as selective cyclin-dependent kinase inhinitors	20120301
EP-2820020-B1	Pyrazolo-triazine derivatives as selective cyclin-dependent kinase inhibitors	20120301
US-2015018329-A1	Pharmaceutically active pyrazolo-triazine derivatives	20120301
WO-2013128028-A1	Pyrazolo - triazine derivatives as selective cyclin- dependent kinase inhinitors	20120301
US-2010179166-A1	Carboxamide heterocyclic cgrp receptor antagonists	20070605

Related Products

Online Inquiry

Name:

* Phone:

* Service & Products of Interested:

Project Description:

* Quantity:

* Email:

* Verification Code:

Customer Support

If the product you need is not in our catalog, please contact us in time to submit your needs. You can help our website get better and better. Why not submit the request today?

Submit Requirement

Customer Centered

Global Delivery

Warehouses in multiple cities to ensure fast delivery

Quality Assurance

Strict process parameter control to ensure product quality

Large Stock

> 20,000 building blocks and intermediates from stock

Process Scale-up

Process scale-up from lab to industrial scale

Flexible Batch Size

Flexible batch size for diverse industrial demands

Related Functional Groups

Triazole/Tetrazole

[6926-51-8]
5-(4-Methoxyphenyl)-2H-tetrazole
[1823462-45-8]
Ethyl 2-(3-chloro-1H-1,2,4-triazol-1-yl)butanoate
[1823967-22-1]
Ethyl 2-(3-chloro-1H-1,2,4-triazol-1-yl)propanoate
[1823783-80-7]
Ethyl 4-(3-bromo-1H-1,2,4-triazol-1-yl)butanoate
[1823842-92-7]
Ethyl 4-(5-chloro-1H-1,2,4-triazol-1-yl)butanoate
[138169-43-4]
MTS Reagent

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

Complexity:	162
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	174.090546336
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	174.090546336
Rotatable Bond Count:	2
Topological Polar Surface Area:	56.7 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.5