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1039884-87-1

1039884-87-1 | 2-iodo-N-(thiophen-3-ylmethyl)aniline

CAS No: 1039884-87-1 Catalog No: AG01AYG9 MDL No:MFCD11194422

Product Description

Catalog Number:
AG01AYG9
Chemical Name:
2-iodo-N-(thiophen-3-ylmethyl)aniline
CAS Number:
1039884-87-1
Molecular Formula:
C11H10INS
Molecular Weight:
315.1733
MDL Number:
MFCD11194422
IUPAC Name:
2-iodo-N-(thiophen-3-ylmethyl)aniline
InChI:
InChI=1S/C11H10INS/c12-10-3-1-2-4-11(10)13-7-9-5-6-14-8-9/h1-6,8,13H,7H2
InChI Key:
CGYUIYJBZKSOIN-UHFFFAOYSA-N
SMILES:
Ic1ccccc1NCc1ccsc1

Properties

Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.958g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
315.172g/mol
Monoisotopic Mass:
314.958g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
40.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  

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