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1820739-56-7 | "N-ethyl-2-(1H-1,2,3-triazol-1-yl)ethan-1-amine hydrochloride"
CAS No: 1820739-56-7 Catalog No: AG01FP8W MDL No:MFCD29046747
Product Description
Catalog Number:
AG01FP8W
Chemical Name:
"N-ethyl-2-(1H-1,2,3-triazol-1-yl)ethan-1-amine hydrochloride"
CAS Number:
1820739-56-7
Molecular Formula:
C6H14Cl2N4
Molecular Weight:
213.1082
MDL Number:
MFCD29046747
IUPAC Name:
N-ethyl-2-(triazol-1-yl)ethanamine
InChI:
InChI=1S/C6H12N4/c1-2-7-3-5-10-6-4-8-9-10/h4,6-7H,2-3,5H2,1H3
InChI Key:
XZLTTZFKHFSKOV-UHFFFAOYSA-N
SMILES:
CCNCCn1nncc1.Cl.Cl
Properties
Complexity:
85.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.106g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
140.19g/mol
Monoisotopic Mass:
140.106g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
42.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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