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20200-62-8 | Spiro[2H-1-benzopyran-2,2'-[2H]indole], 6,8-dibromo-1',3'-dihydro-1',3',3'-trimethyl-
CAS No: 20200-62-8 Catalog No: AG002800 MDL No:
Product Description
Catalog Number:
AG002800
Chemical Name:
Spiro[2H-1-benzopyran-2,2'-[2H]indole], 6,8-dibromo-1',3'-dihydro-1',3',3'-trimethyl-
CAS Number:
20200-62-8
Molecular Formula:
C19H17Br2NO
Molecular Weight:
435.1524
IUPAC Name:
6,8-dibromo-1',3',3'-trimethylspiro[chromene-2,2'-indole]
InChI:
InChI=1S/C19H17Br2NO/c1-18(2)14-6-4-5-7-16(14)22(3)19(18)9-8-12-10-13(20)11-15(21)17(12)23-19/h4-11H,1-3H3
InChI Key:
SGACMEJZUBOUBY-UHFFFAOYSA-N
SMILES:
Brc1cc(Br)c2c(c1)C=CC1(O2)N(C)c2c(C1(C)C)cccc2
Properties
Complexity:
508
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
434.966g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
435.159g/mol
Monoisotopic Mass:
432.968g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
6.3
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