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10164-64-4 | 2-Propanol, 1-amino-, triester with boric acid (H3BO3) (9CI)
CAS No: 10164-64-4 Catalog No: AG00050Y MDL No:
Product Description
Catalog Number:
AG00050Y
Chemical Name:
2-Propanol, 1-amino-, triester with boric acid (H3BO3) (9CI)
CAS Number:
10164-64-4
Molecular Formula:
C9H24BN3O3
Molecular Weight:
233.1162
IUPAC Name:
tris(1-aminopropan-2-yl) borate
InChI:
InChI=1S/C9H24BN3O3/c1-7(4-11)14-10(15-8(2)5-12)16-9(3)6-13/h7-9H,4-6,11-13H2,1-3H3
InChI Key:
SMIBBGLDGBPYJI-UHFFFAOYSA-N
SMILES:
NCC(OB(OC(CN)C)OC(CN)C)C
EC Number:
233-435-1
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.191g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
233.119g/mol
Monoisotopic Mass:
233.191g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
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