Home Other Building Blocks {1-[(4-iodophenyl)methyl]pyrrolidin-2-yl}methanamine

{1-[(4-iodophenyl)methyl]pyrrolidin-2-yl}methanamine

CAS No.:
1481798-77-9
Catalog Number:
AG01BF2X
Molecular Formula:
C12H17IN2
Molecular Weight:
316.1812
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Product Description
Catalog Number:
AG01BF2X
Chemical Name:
{1-[(4-iodophenyl)methyl]pyrrolidin-2-yl}methanamine
CAS Number:
1481798-77-9
Molecular Formula:
C12H17IN2
Molecular Weight:
316.1812
MDL Number:
MFCD21243125
IUPAC Name:
[1-[(4-iodophenyl)methyl]pyrrolidin-2-yl]methanamine
InChI:
InChI=1S/C12H17IN2/c13-11-5-3-10(4-6-11)9-15-7-1-2-12(15)8-14/h3-6,12H,1-2,7-9,14H2
InChI Key:
YKDLYSARECBXAQ-UHFFFAOYSA-N
SMILES:
NCC1CCCN1Cc1ccc(cc1)I
Properties
Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.044g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
316.186g/mol
Monoisotopic Mass:
316.044g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties