Home Other Building Blocks 1-(1H-1,2,3,4-tetrazol-5-yl)propan-1-amine

1-(1H-1,2,3,4-tetrazol-5-yl)propan-1-amine

CAS No.:
31603-03-9
Catalog Number:
AG01AH6W
Molecular Formula:
C4H9N5
Molecular Weight:
127.1478
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01AH6W
Chemical Name:
1-(1H-1,2,3,4-tetrazol-5-yl)propan-1-amine
CAS Number:
31603-03-9
Molecular Formula:
C4H9N5
Molecular Weight:
127.1478
MDL Number:
MFCD03931083
IUPAC Name:
1-(2H-tetrazol-5-yl)propan-1-amine
InChI:
InChI=1S/C4H9N5/c1-2-3(5)4-6-8-9-7-4/h3H,2,5H2,1H3,(H,6,7,8,9)
InChI Key:
DOFDXNNXHHZWCT-UHFFFAOYSA-N
SMILES:
CCC(c1nnn[nH]1)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:
127.086g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
127.151g/mol
Monoisotopic Mass:
127.086g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
80.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
Properties