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1263198-93-1 | Benzenemethanamine, α-(2-methylpropyl)-, hydrochloride (1:1), (αR)-
CAS No: 1263198-93-1 Catalog No: AG000SK9 MDL No:MFCD12910550
Product Description
Catalog Number:
AG000SK9
Chemical Name:
Benzenemethanamine, α-(2-methylpropyl)-, hydrochloride (1:1), (αR)-
CAS Number:
1263198-93-1
Molecular Formula:
C11H18ClN
Molecular Weight:
199.7203
MDL Number:
MFCD12910550
IUPAC Name:
(1R)-3-methyl-1-phenylbutan-1-amine;hydrochloride
InChI:
InChI=1S/C11H17N.ClH/c1-9(2)8-11(12)10-6-4-3-5-7-10;/h3-7,9,11H,8,12H2,1-2H3;1H/t11-;/m1./s1
InChI Key:
HNQTWZNKDACDLN-RFVHGSKJSA-N
SMILES:
N[C@@H](c1ccccc1)CC(C)C.Cl
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
199.113g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
199.722g/mol
Monoisotopic Mass:
199.113g/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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