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1822-25-9 | Tricyclo[3.3.1.13,7]decane, 1-bromo-3-(bromomethyl)-
CAS No: 1822-25-9 Catalog No: AG0023HH MDL No:MFCD00185299
Product Description
Catalog Number:
AG0023HH
Chemical Name:
Tricyclo[3.3.1.13,7]decane, 1-bromo-3-(bromomethyl)-
CAS Number:
1822-25-9
Molecular Formula:
C11H16Br2
Molecular Weight:
308.0527
MDL Number:
MFCD00185299
IUPAC Name:
1-bromo-3-(bromomethyl)adamantane
InChI:
InChI=1S/C11H16Br2/c12-7-10-2-8-1-9(3-10)5-11(13,4-8)6-10/h8-9H,1-7H2
InChI Key:
SKQVGBXLHPBGHY-UHFFFAOYSA-N
SMILES:
BrCC12CC3CC(C1)CC(C2)(C3)Br
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.96g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
308.057g/mol
Monoisotopic Mass:
305.962g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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