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Home > Bromides > 2138104-29-5
2138104-29-5 | 4-bromo-3,3,7-trimethyl-2,3-dihydro-1H-indole hydrochloride
CAS No: 2138104-29-5 Catalog No: AG01EL76 MDL No:MFCD31559015
Product Description
Catalog Number:
AG01EL76
Chemical Name:
4-bromo-3,3,7-trimethyl-2,3-dihydro-1H-indole hydrochloride
CAS Number:
2138104-29-5
Molecular Formula:
C11H15BrClN
Molecular Weight:
276.6005
MDL Number:
MFCD31559015
IUPAC Name:
4-bromo-3,3,7-trimethyl-1,2-dihydroindole;hydrochloride
InChI:
InChI=1S/C11H14BrN.ClH/c1-7-4-5-8(12)9-10(7)13-6-11(9,2)3;/h4-5,13H,6H2,1-3H3;1H
InChI Key:
QOMBTCBNGGTJCP-UHFFFAOYSA-N
SMILES:
Brc1ccc(c2c1C(C)(C)CN2)C.Cl
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.008g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
276.602g/mol
Monoisotopic Mass:
275.008g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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