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263903-19-1 | 2H-1-Benzopyran, 5-bromo-3,4-dihydro-2,2-dimethyl-
CAS No: 263903-19-1 Catalog No: AG002T0F MDL No:
Product Description
Catalog Number:
AG002T0F
Chemical Name:
2H-1-Benzopyran, 5-bromo-3,4-dihydro-2,2-dimethyl-
CAS Number:
263903-19-1
Molecular Formula:
C11H13BrO
Molecular Weight:
241.1243
IUPAC Name:
5-bromo-2,2-dimethyl-3,4-dihydrochromene
InChI:
InChI=1S/C11H13BrO/c1-11(2)7-6-8-9(12)4-3-5-10(8)13-11/h3-5H,6-7H2,1-2H3
InChI Key:
CNWNDWHYOFPMGQ-UHFFFAOYSA-N
SMILES:
CC1(C)CCc2c(O1)cccc2Br
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.015g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.128g/mol
Monoisotopic Mass:
240.015g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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