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1500292-98-7 | 2-[(4-iodophenyl)methyl]-2-methylpyrrolidine
CAS No: 1500292-98-7 Catalog No: AG01BTI2 MDL No:MFCD21780582
Product Description
Catalog Number:
AG01BTI2
Chemical Name:
2-[(4-iodophenyl)methyl]-2-methylpyrrolidine
CAS Number:
1500292-98-7
Molecular Formula:
C12H16IN
Molecular Weight:
301.1666
MDL Number:
MFCD21780582
IUPAC Name:
2-[(4-iodophenyl)methyl]-2-methylpyrrolidine
InChI:
InChI=1S/C12H16IN/c1-12(7-2-8-14-12)9-10-3-5-11(13)6-4-10/h3-6,14H,2,7-9H2,1H3
InChI Key:
SDWMJIVZLCXGGR-UHFFFAOYSA-N
SMILES:
Ic1ccc(cc1)CC1(C)CCCN1
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.033g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
301.171g/mol
Monoisotopic Mass:
301.033g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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