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5845-30-7 | 3-Bromo-N,N-dimethyl-1-propylamine Hydrobromide
CAS No: 5845-30-7 Catalog No: AG0033MW MDL No:MFCD11109991
Product Description
Catalog Number:
AG0033MW
Chemical Name:
3-Bromo-N,N-dimethyl-1-propylamine Hydrobromide
CAS Number:
5845-30-7
Molecular Formula:
C5H13Br2N
Molecular Weight:
246.9714
MDL Number:
MFCD11109991
IUPAC Name:
3-bromo-N,N-dimethylpropan-1-amine;hydrobromide
InChI:
InChI=1S/C5H12BrN.BrH/c1-7(2)5-3-4-6;/h3-5H2,1-2H3;1H
InChI Key:
IDBJSERXBDUKCD-UHFFFAOYSA-N
SMILES:
BrCCCN(C)C.Br
Properties
Complexity:
37.1
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:
3
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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