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1015846-51-1 | 1H-1,2,4-Triazole-5-methanamine, 1-ethyl-α-methyl-
CAS No: 1015846-51-1 Catalog No: AG0004WX MDL No:MFCD09971251
Product Description
Catalog Number:
AG0004WX
Chemical Name:
1H-1,2,4-Triazole-5-methanamine, 1-ethyl-α-methyl-
CAS Number:
1015846-51-1
Molecular Formula:
C6H12N4
Molecular Weight:
140.1863
MDL Number:
MFCD09971251
IUPAC Name:
1-(2-ethyl-1,2,4-triazol-3-yl)ethanamine
InChI:
InChI=1S/C6H12N4/c1-3-10-6(5(2)7)8-4-9-10/h4-5H,3,7H2,1-2H3
InChI Key:
BSQRPRIGWJTGNY-UHFFFAOYSA-N
SMILES:
CCn1ncnc1C(N)C
Properties
Complexity:
106
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:
2
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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