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2055841-16-0 | 3-Azetidinamine, 1-phenyl-, hydrochloride (1:2)
CAS No: 2055841-16-0 Catalog No: AG002A81 MDL No:
Product Description
Catalog Number:
AG002A81
Chemical Name:
3-Azetidinamine, 1-phenyl-, hydrochloride (1:2)
CAS Number:
2055841-16-0
Molecular Formula:
C9H14Cl2N2
Molecular Weight:
221.1269
IUPAC Name:
1-phenylazetidin-3-amine;dihydrochloride
InChI:
InChI=1S/C9H12N2.2ClH/c10-8-6-11(7-8)9-4-2-1-3-5-9;;/h1-5,8H,6-7,10H2;2*1H
InChI Key:
UVRDDYMQRPZLIX-UHFFFAOYSA-N
SMILES:
NC1CN(C1)c1ccccc1.Cl.Cl
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.053g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
221.125g/mol
Monoisotopic Mass:
220.053g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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