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17684-35-4 | Benzenepropanamine, γ,γ-dimethyl-, hydrochloride (1:1)
CAS No: 17684-35-4 Catalog No: AG0024Z9 MDL No:MFCD12913693
Product Description
Catalog Number:
AG0024Z9
Chemical Name:
Benzenepropanamine, γ,γ-dimethyl-, hydrochloride (1:1)
CAS Number:
17684-35-4
Molecular Formula:
C11H18ClN
Molecular Weight:
199.7203
MDL Number:
MFCD12913693
IUPAC Name:
3-methyl-3-phenylbutan-1-amine;hydrochloride
InChI:
InChI=1S/C11H17N.ClH/c1-11(2,8-9-12)10-6-4-3-5-7-10;/h3-7H,8-9,12H2,1-2H3;1H
InChI Key:
BTMVAPBFIHOQEY-UHFFFAOYSA-N
SMILES:
NCCC(c1ccccc1)(C)C.Cl
Properties
Complexity:
123
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
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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