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87740-24-7 | Benzenamine, 3-[(phenylseleno)methyl]-, hydrochloride
CAS No: 87740-24-7 Catalog No: AG004IOO MDL No:
Product Description
Catalog Number:
AG004IOO
Chemical Name:
Benzenamine, 3-[(phenylseleno)methyl]-, hydrochloride
CAS Number:
87740-24-7
Molecular Formula:
C13H14ClNSe
Molecular Weight:
298.6700
IUPAC Name:
3-(phenylselanylmethyl)aniline;hydrochloride
InChI:
InChI=1S/C13H13NSe.ClH/c14-12-6-4-5-11(9-12)10-15-13-7-2-1-3-8-13;/h1-9H,10,14H2;1H
InChI Key:
OHNWLIPTJQXOGN-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)C[Se]c1ccccc1.Cl
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.998g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
298.683g/mol
Monoisotopic Mass:
298.998g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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