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88512-79-2 | 1-Propanamine, 2-bromo-N,N-dimethyl-, hydrobromide
CAS No: 88512-79-2 Catalog No: AG00489H MDL No:
Product Description
Catalog Number:
AG00489H
Chemical Name:
1-Propanamine, 2-bromo-N,N-dimethyl-, hydrobromide
CAS Number:
88512-79-2
Molecular Formula:
C5H13Br2N
Molecular Weight:
246.9714
IUPAC Name:
2-bromo-N,N-dimethylpropan-1-amine;hydrobromide
InChI:
InChI=1S/C5H12BrN.BrH/c1-5(6)4-7(2)3;/h5H,4H2,1-3H3;1H
InChI Key:
FYPXYIGNROSDHN-UHFFFAOYSA-N
SMILES:
CN(CC(Br)C)C.Br
Properties
Complexity:
45.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.939g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
246.974g/mol
Monoisotopic Mass:
244.941g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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