Home Other Building Blocks 3-(thiomorpholin-4-ylmethyl)aniline

3-(thiomorpholin-4-ylmethyl)aniline

CAS No.:
237432-15-4
Catalog Number:
AG01A7Z8
Molecular Formula:
C11H16N2S
Molecular Weight:
208.3231
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Product Description
Catalog Number:
AG01A7Z8
Chemical Name:
3-(thiomorpholin-4-ylmethyl)aniline
CAS Number:
237432-15-4
Molecular Formula:
C11H16N2S
Molecular Weight:
208.3231
MDL Number:
MFCD11172064
IUPAC Name:
3-(thiomorpholin-4-ylmethyl)aniline
InChI:
InChI=1S/C11H16N2S/c12-11-3-1-2-10(8-11)9-13-4-6-14-7-5-13/h1-3,8H,4-7,9,12H2
InChI Key:
TUTPFTCILWEGMR-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)CN1CCSCC1
Properties
Complexity:
169  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.103g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
208.323g/mol
Monoisotopic Mass:
208.103g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties