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89221-08-9 | Benzenamine, 4-(1-ethyl-1H-1,2,3-triazol-4-yl)-
CAS No: 89221-08-9 Catalog No: AG0043M4 MDL No:MFCD20715241
Product Description
Catalog Number:
AG0043M4
Chemical Name:
Benzenamine, 4-(1-ethyl-1H-1,2,3-triazol-4-yl)-
CAS Number:
89221-08-9
Molecular Formula:
C10H12N4
Molecular Weight:
188.2291
MDL Number:
MFCD20715241
IUPAC Name:
4-(1-ethyltriazol-4-yl)aniline
InChI:
InChI=1S/C10H12N4/c1-2-14-7-10(12-13-14)8-3-5-9(11)6-4-8/h3-7H,2,11H2,1H3
InChI Key:
OUTBFHSRDZLMCP-UHFFFAOYSA-N
SMILES:
CCn1nnc(c1)c1ccc(cc1)N
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.106g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
188.234g/mol
Monoisotopic Mass:
188.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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