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883545-31-1 | 1-(1H-1,2,4-TRIAZOL-1-YL)PROPAN-2-AMINE
CAS No: 883545-31-1 Catalog No: AG00459X MDL No:MFCD08144081
Product Description
Catalog Number:
AG00459X
Chemical Name:
1-(1H-1,2,4-TRIAZOL-1-YL)PROPAN-2-AMINE
CAS Number:
883545-31-1
Molecular Formula:
C5H10N4
Molecular Weight:
126.1597
MDL Number:
MFCD08144081
IUPAC Name:
1-(1,2,4-triazol-1-yl)propan-2-amine
InChI:
InChI=1S/C5H10N4/c1-5(6)2-9-4-7-3-8-9/h3-5H,2,6H2,1H3
InChI Key:
ZTZDXHFMAKRNMX-UHFFFAOYSA-N
SMILES:
CC(Cn1cncn1)N
Properties
Complexity:
85
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.091g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
126.163g/mol
Monoisotopic Mass:
126.091g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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