Home Other Building Blocks 3,5-difluoro-4-(methylsulfanyl)aniline

3,5-difluoro-4-(methylsulfanyl)aniline

CAS No.:
1184373-72-5
Catalog Number:
AG01A6E2
Molecular Formula:
C7H7F2NS
Molecular Weight:
175.1990
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Product Description
Catalog Number:
AG01A6E2
Chemical Name:
3,5-difluoro-4-(methylsulfanyl)aniline
CAS Number:
1184373-72-5
Molecular Formula:
C7H7F2NS
Molecular Weight:
175.1990
MDL Number:
MFCD12779536
IUPAC Name:
3,5-difluoro-4-methylsulfanylaniline
InChI:
InChI=1S/C7H7F2NS/c1-11-7-5(8)2-4(10)3-6(7)9/h2-3H,10H2,1H3
InChI Key:
PGCXTVKXVYMUBR-UHFFFAOYSA-N
SMILES:
CSc1c(F)cc(cc1F)N
Properties
Complexity:
122  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.027g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
175.197g/mol
Monoisotopic Mass:
175.027g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
51.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties