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1190965-20-8 | Spiro[isobenzofuran-1(3H),4'-piperidine], 5-chloro-, hydrochloride (1:1)
CAS No: 1190965-20-8 Catalog No: AG000I5L MDL No:MFCD20921940
Product Description
Catalog Number:
AG000I5L
Chemical Name:
Spiro[isobenzofuran-1(3H),4'-piperidine], 5-chloro-, hydrochloride (1:1)
CAS Number:
1190965-20-8
Molecular Formula:
C12H15Cl2NO
Molecular Weight:
260.1596
MDL Number:
MFCD20921940
IUPAC Name:
6-chlorospiro[1H-2-benzofuran-3,4'-piperidine];hydrochloride
InChI:
InChI=1S/C12H14ClNO.ClH/c13-10-1-2-11-9(7-10)8-15-12(11)3-5-14-6-4-12;/h1-2,7,14H,3-6,8H2;1H
InChI Key:
NFTNNBIFCJHYIW-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)COC12CCNCC1.Cl
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.053g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
260.158g/mol
Monoisotopic Mass:
259.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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