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204503-25-3 | Benzene, 1-bromo-4-[(3-methyl-2-buten-1-yl)oxy]-
CAS No: 204503-25-3 Catalog No: AG0029J3 MDL No:
Product Description
Catalog Number:
AG0029J3
Chemical Name:
Benzene, 1-bromo-4-[(3-methyl-2-buten-1-yl)oxy]-
CAS Number:
204503-25-3
Molecular Formula:
C11H13BrO
Molecular Weight:
241.1243
IUPAC Name:
1-bromo-4-(3-methylbut-2-enoxy)benzene
InChI:
InChI=1S/C11H13BrO/c1-9(2)7-8-13-11-5-3-10(12)4-6-11/h3-7H,8H2,1-2H3
InChI Key:
QCGPJGRUUQSVNR-UHFFFAOYSA-N
SMILES:
CC(=CCOc1ccc(cc1)Br)C
Properties
Complexity:
165
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:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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