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Home > Bromides > 1363166-31-7
1363166-31-7 | 2-Naphthaleneacetic acid, 6-methoxy-α-methyl-, 5-bromo-2-naphthalenyl ester
CAS No: 1363166-31-7 Catalog No: AG0011ML MDL No:MFCD21641336
Product Description
Catalog Number:
AG0011ML
Chemical Name:
2-Naphthaleneacetic acid, 6-methoxy-α-methyl-, 5-bromo-2-naphthalenyl ester
CAS Number:
1363166-31-7
Molecular Formula:
C24H19BrO3
Molecular Weight:
435.3099
MDL Number:
MFCD21641336
IUPAC Name:
(5-bromonaphthalen-2-yl) 2-(6-methoxynaphthalen-2-yl)propanoate
InChI:
InChI=1S/C24H19BrO3/c1-15(16-6-7-18-13-20(27-2)9-8-17(18)12-16)24(26)28-21-10-11-22-19(14-21)4-3-5-23(22)25/h3-15H,1-2H3
InChI Key:
IEVYZTREZUZVFL-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)ccc(c2)C(C(=O)Oc1ccc2c(c1)cccc2Br)C
Properties
Complexity:
538
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
434.052g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
435.317g/mol
Monoisotopic Mass:
434.052g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
7
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