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Home > Boronic Acids > 76873-75-1
76873-75-1 | Boronic acid, (1-methylethyl)-, dipropyl ester
CAS No: 76873-75-1 Catalog No: AG005S3H MDL No:
Product Description
Catalog Number:
AG005S3H
Chemical Name:
Boronic acid, (1-methylethyl)-, dipropyl ester
CAS Number:
76873-75-1
Molecular Formula:
C9H21BO2
Molecular Weight:
172.0728
IUPAC Name:
propan-2-yl(dipropoxy)borane
InChI:
InChI=1S/C9H21BO2/c1-5-7-11-10(9(3)4)12-8-6-2/h9H,5-8H2,1-4H3
InChI Key:
ZPAQPUPBPSCAJZ-UHFFFAOYSA-N
SMILES:
CCCOB(C(C)C)OCCC
Properties
Complexity:
88.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.163g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.075g/mol
Monoisotopic Mass:
172.163g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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