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1220033-11-3 | Pyrrolidine, 3-[(2,4-dichlorophenyl)methoxy]-, hydrochloride (1:1)
CAS No: 1220033-11-3 Catalog No: AG0016K5 MDL No:MFCD13561014
Product Description
Catalog Number:
AG0016K5
Chemical Name:
Pyrrolidine, 3-[(2,4-dichlorophenyl)methoxy]-, hydrochloride (1:1)
CAS Number:
1220033-11-3
Molecular Formula:
C11H14Cl3NO
Molecular Weight:
282.5940
MDL Number:
MFCD13561014
IUPAC Name:
3-[(2,4-dichlorophenyl)methoxy]pyrrolidine;hydrochloride
InChI:
InChI=1S/C11H13Cl2NO.ClH/c12-9-2-1-8(11(13)5-9)7-15-10-3-4-14-6-10;/h1-2,5,10,14H,3-4,6-7H2;1H
InChI Key:
GGNMWLWPDGQZSC-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)Cl)COC1CNCC1.Cl
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.014g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
282.589g/mol
Monoisotopic Mass:
281.014g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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