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23567-67-1

23567-67-1 | Phenol, 4-(1,2,3,4-thiatriazol-5-ylamino)-

CAS No: 23567-67-1 Catalog No: AG002NOR MDL No:MFCD00003131

Product Description

Catalog Number:
AG002NOR
Chemical Name:
Phenol, 4-(1,2,3,4-thiatriazol-5-ylamino)-
CAS Number:
23567-67-1
Molecular Formula:
C7H6N4OS
Molecular Weight:
194.2137
MDL Number:
MFCD00003131
IUPAC Name:
4-(thiatriazol-5-ylamino)phenol
InChI:
InChI=1S/C7H6N4OS/c12-6-3-1-5(2-4-6)8-7-9-10-11-13-7/h1-4,12H,(H,8,9,11)
InChI Key:
HSMPDEMRJJNQME-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)Nc1nnns1
EC Number:
245-745-4
UNII:
E2QU2ZKF55

Properties

Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.026g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
194.212g/mol
Monoisotopic Mass:
194.026g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
99.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

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