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1391455-00-7 | Benzenemethanamine, α-cyclopropyl-3-methoxy-, hydrochloride (1:1), (αR)-
CAS No: 1391455-00-7 Catalog No: AG001AEF MDL No:MFCD19705372
Product Description
Catalog Number:
AG001AEF
Chemical Name:
Benzenemethanamine, α-cyclopropyl-3-methoxy-, hydrochloride (1:1), (αR)-
CAS Number:
1391455-00-7
Molecular Formula:
C11H16ClNO
Molecular Weight:
213.7038
MDL Number:
MFCD19705372
IUPAC Name:
(R)-cyclopropyl-(3-methoxyphenyl)methanamine;hydrochloride
InChI:
InChI=1S/C11H15NO.ClH/c1-13-10-4-2-3-9(7-10)11(12)8-5-6-8;/h2-4,7-8,11H,5-6,12H2,1H3;1H/t11-;/m1./s1
InChI Key:
YZEPXOHQBWEEEY-RFVHGSKJSA-N
SMILES:
COc1cccc(c1)[C@@H](C1CC1)N.Cl
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
213.092g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
213.705g/mol
Monoisotopic Mass:
213.092g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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