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1263376-62-0

1263376-62-0 | 4-Bromo-2-fluoro-5-methylphenylthiourea

CAS No: 1263376-62-0 Catalog No: AG01FC9O MDL No:MFCD18379885

Product Description

Catalog Number:
AG01FC9O
Chemical Name:
4-Bromo-2-fluoro-5-methylphenylthiourea
CAS Number:
1263376-62-0
Molecular Formula:
C8H8BrFN2S
Molecular Weight:
263.1299
MDL Number:
MFCD18379885
IUPAC Name:
(4-bromo-2-fluoro-5-methylphenyl)thiourea
InChI:
InChI=1S/C8H8BrFN2S/c1-4-2-7(12-8(11)13)6(10)3-5(4)9/h2-3H,1H3,(H3,11,12,13)
InChI Key:
HGWJJZJPIVCHOA-UHFFFAOYSA-N
SMILES:
NC(=S)Nc1cc(C)c(cc1F)Br

Properties

Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.958g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
263.128g/mol
Monoisotopic Mass:
261.958g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

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