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874015-38-0 | (S)-1-(o-Tolyl)propan-1-amine hydrochloride
CAS No: 874015-38-0 Catalog No: AG004GP5 MDL No:
Product Description
Catalog Number:
AG004GP5
Chemical Name:
(S)-1-(o-Tolyl)propan-1-amine hydrochloride
CAS Number:
874015-38-0
Molecular Formula:
C10H16ClN
Molecular Weight:
185.6937
IUPAC Name:
(1S)-1-(2-methylphenyl)propan-1-amine;hydrochloride
InChI:
InChI=1S/C10H15N.ClH/c1-3-10(11)9-7-5-4-6-8(9)2;/h4-7,10H,3,11H2,1-2H3;1H/t10-;/m0./s1
InChI Key:
ZRFSFSDKCOAXNJ-PPHPATTJSA-N
SMILES:
CC[C@@H](c1ccccc1C)N.Cl
Properties
Complexity:
111
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
185.097g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
185.695g/mol
Monoisotopic Mass:
185.097g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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