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Home > Boronic Acids > 1704081-47-9
1704081-47-9 | (3-chloro-4-(3-(4-ethylpiperazin-1-yl)propoxy)phenyl)boronic acid
CAS No: 1704081-47-9 Catalog No: AG00ARAE MDL No:MFCD28400433
Product Description
Catalog Number:
AG00ARAE
Chemical Name:
(3-chloro-4-(3-(4-ethylpiperazin-1-yl)propoxy)phenyl)boronic acid
CAS Number:
1704081-47-9
MDL Number:
MFCD28400433
IUPAC Name:
[3-chloro-4-[3-(4-ethylpiperazin-1-yl)propoxy]phenyl]boronic acid
InChI:
InChI=1S/C15H24BClN2O3/c1-2-18-7-9-19(10-8-18)6-3-11-22-15-5-4-13(16(20)21)12-14(15)17/h4-5,12,20-21H,2-3,6-11H2,1H3
InChI Key:
RTUOCNXSDYLPEX-UHFFFAOYSA-N
Properties
Complexity:
317
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
326.157g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
326.628g/mol
Monoisotopic Mass:
326.157g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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