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88806-01-3 | Piperidine, 1-(3-bromopropyl)-2-methyl-, hydrobromide
CAS No: 88806-01-3 Catalog No: AG004CK2 MDL No:
Product Description
Catalog Number:
AG004CK2
Chemical Name:
Piperidine, 1-(3-bromopropyl)-2-methyl-, hydrobromide
CAS Number:
88806-01-3
Molecular Formula:
C9H19Br2N
Molecular Weight:
301.0619
IUPAC Name:
1-(3-bromopropyl)-2-methylpiperidine;hydrobromide
InChI:
InChI=1S/C9H18BrN.BrH/c1-9-5-2-3-7-11(9)8-4-6-10;/h9H,2-8H2,1H3;1H
InChI Key:
UTJDEXFNKMEKPL-UHFFFAOYSA-N
SMILES:
BrCCCN1CCCCC1C.Br
Properties
Complexity:
106
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.986g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
301.066g/mol
Monoisotopic Mass:
298.988g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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