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Home > Boronic Acids > 28741-07-3
28741-07-3 | N-HEPTANEBORONIC ACID
CAS No: 28741-07-3 Catalog No: AG00BDTE MDL No:MFCD06201026
Product Description
Catalog Number:
AG00BDTE
Chemical Name:
N-HEPTANEBORONIC ACID
CAS Number:
28741-07-3
Molecular Formula:
C7H17BO2
Molecular Weight:
144.0197
MDL Number:
MFCD06201026
IUPAC Name:
heptylboronic acid
InChI:
InChI=1S/C7H17BO2/c1-2-3-4-5-6-7-8(9)10/h9-10H,2-7H2,1H3
InChI Key:
JDHPHWYPXVFZKA-UHFFFAOYSA-N
SMILES:
CCCCCCCB(O)O
Properties
Complexity:
66.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.132g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
144.021g/mol
Monoisotopic Mass:
144.132g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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