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1380300-27-5 | 4-(2-Methoxyphenyl)oxan-4-amine hydrochloride
CAS No: 1380300-27-5 Catalog No: AG01FAC9 MDL No:
Product Description
Catalog Number:
AG01FAC9
Chemical Name:
4-(2-Methoxyphenyl)oxan-4-amine hydrochloride
CAS Number:
1380300-27-5
Molecular Formula:
C12H18ClNO2
Molecular Weight:
243.7298
IUPAC Name:
4-(2-methoxyphenyl)oxan-4-amine;hydrochloride
InChI:
InChI=1S/C12H17NO2.ClH/c1-14-11-5-3-2-4-10(11)12(13)6-8-15-9-7-12;/h2-5H,6-9,13H2,1H3;1H
InChI Key:
VBKJVAIYQULSFT-UHFFFAOYSA-N
SMILES:
COc1ccccc1C1(N)CCOCC1.Cl
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.103g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
243.731g/mol
Monoisotopic Mass:
243.103g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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