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88953-81-5 | 1,3,2-Dioxaborinane, 5-ethyl-4-methyl-2-(1-methylethyl)-, cis-
CAS No: 88953-81-5 Catalog No: AG00477D MDL No:
Product Description
Catalog Number:
AG00477D
Chemical Name:
1,3,2-Dioxaborinane, 5-ethyl-4-methyl-2-(1-methylethyl)-, cis-
CAS Number:
88953-81-5
Molecular Formula:
C9H19BO2
Molecular Weight:
170.0570
IUPAC Name:
5-ethyl-4-methyl-2-propan-2-yl-1,3,2-dioxaborinane
InChI:
InChI=1S/C9H19BO2/c1-5-9-6-11-10(7(2)3)12-8(9)4/h7-9H,5-6H2,1-4H3
InChI Key:
YJWMPFNRRZONOA-UHFFFAOYSA-N
SMILES:
CC[C@H]1COB(O[C@H]1C)C(C)C
Properties
Complexity:
139
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.148g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.059g/mol
Monoisotopic Mass:
170.148g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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