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122893-33-8 | Benzenemethanamine, 4-[2-(1-pyrrolidinyl)ethoxy]-
CAS No: 122893-33-8 Catalog No: AG000JPS MDL No:MFCD08699714
Product Description
Catalog Number:
AG000JPS
Chemical Name:
Benzenemethanamine, 4-[2-(1-pyrrolidinyl)ethoxy]-
CAS Number:
122893-33-8
Molecular Formula:
C13H20N2O
Molecular Weight:
220.3107
MDL Number:
MFCD08699714
IUPAC Name:
[4-(2-pyrrolidin-1-ylethoxy)phenyl]methanamine
InChI:
InChI=1S/C13H20N2O/c14-11-12-3-5-13(6-4-12)16-10-9-15-7-1-2-8-15/h3-6H,1-2,7-11,14H2
InChI Key:
MZTRPMDTKZJSDX-UHFFFAOYSA-N
SMILES:
NCc1ccc(cc1)OCCN1CCCC1
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.158g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
220.316g/mol
Monoisotopic Mass:
220.158g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
38.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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