Home Other Building Blocks 5-(2-phenylethyl)-1H-1,2,3,4-tetrazole

5-(2-phenylethyl)-1H-1,2,3,4-tetrazole

CAS No.:
192505-33-2
Catalog Number:
AG01ACAY
Molecular Formula:
C9H10N4
Molecular Weight:
174.2025
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01ACAY
Chemical Name:
5-(2-phenylethyl)-1H-1,2,3,4-tetrazole
CAS Number:
192505-33-2
Molecular Formula:
C9H10N4
Molecular Weight:
174.2025
MDL Number:
MFCD11156015
IUPAC Name:
5-(2-phenylethyl)-2H-tetrazole
InChI:
InChI=1S/C9H10N4/c1-2-4-8(5-3-1)6-7-9-10-12-13-11-9/h1-5H,6-7H2,(H,10,11,12,13)
InChI Key:
AFVBZUWBUBBTKS-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CCc1nnn[nH]1
NSC Number:
11122
Properties
Complexity:
145  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.091g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
174.207g/mol
Monoisotopic Mass:
174.091g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
54.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties