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1039971-27-1 | 2-iodo-N-(thiophen-2-ylmethyl)aniline
CAS No: 1039971-27-1 Catalog No: AG01AWH7 MDL No:MFCD11177909
Product Description
Catalog Number:
AG01AWH7
Chemical Name:
2-iodo-N-(thiophen-2-ylmethyl)aniline
CAS Number:
1039971-27-1
Molecular Formula:
C11H10INS
Molecular Weight:
315.1733
MDL Number:
MFCD11177909
IUPAC Name:
2-iodo-N-(thiophen-2-ylmethyl)aniline
InChI:
InChI=1S/C11H10INS/c12-10-5-1-2-6-11(10)13-8-9-4-3-7-14-9/h1-7,13H,8H2
InChI Key:
DDIPKQSVIHCTOT-UHFFFAOYSA-N
SMILES:
Ic1ccccc1NCc1cccs1
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:
3.8
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