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19985-09-2 | 3-Pyrrolidinamine, 1-(1-methylethyl)-, hydrochloride (1:2)
CAS No: 19985-09-2 Catalog No: AG002CE0 MDL No:MFCD08544449
Product Description
Catalog Number:
AG002CE0
Chemical Name:
3-Pyrrolidinamine, 1-(1-methylethyl)-, hydrochloride (1:2)
CAS Number:
19985-09-2
Molecular Formula:
C7H18Cl2N2
Molecular Weight:
201.1372
MDL Number:
MFCD08544449
IUPAC Name:
1-propan-2-ylpyrrolidin-3-amine;dihydrochloride
InChI:
InChI=1S/C7H16N2.2ClH/c1-6(2)9-4-3-7(8)5-9;;/h6-7H,3-5,8H2,1-2H3;2*1H
InChI Key:
VBJDQXDPLUEPER-UHFFFAOYSA-N
SMILES:
NC1CCN(C1)C(C)C.Cl.Cl
Properties
Complexity:
90.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.085g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
201.135g/mol
Monoisotopic Mass:
200.085g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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