200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 1173167-11-7
1173167-11-7 | (S)-Borovaline-(-)-pinanediol-HCl
CAS No: 1173167-11-7 Catalog No: AG018Q4E MDL No:MFCD16294356
Product Description
Catalog Number:
AG018Q4E
Chemical Name:
(S)-Borovaline-(-)-pinanediol-HCl
CAS Number:
1173167-11-7
Molecular Formula:
C14H27BClNO2
Molecular Weight:
287.6337
MDL Number:
MFCD16294356
IUPAC Name:
(1S)-2-methyl-1-[(1R,2R,6S,8R)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.02,6]decan-4-yl]propan-1-amine;hydrochloride
InChI:
InChI=1S/C14H26BNO2.ClH/c1-8(2)12(16)15-17-11-7-9-6-10(13(9,3)4)14(11,5)18-15;/h8-12H,6-7,16H2,1-5H3;1H/t9-,10-,11+,12-,14-;/m1./s1
InChI Key:
KVVHHYLDRUDGST-NTEAFONJSA-N
SMILES:
CC([C@H](B1O[C@@H]2[C@@](O1)(C)[C@@H]1C[C@H](C2)C1(C)C)N)C.Cl
Properties
Complexity:
360
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
5
Defined Bond Stereocenter Count:
0
Exact Mass:
287.182g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
287.635g/mol
Monoisotopic Mass:
287.182g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.