Name: Name:(3,5-diMethyl-4-(pyrrolidin-1-ylsulfonyl)phenyl)boronic acid
Brand: Angene
SKU: AG00AR9Y
Rating: 90 (10 reviews)

(3,5-diMethyl-4-(pyrrolidin-1-ylsulfonyl)phenyl)boronic acid

CAS No.:

1704066-99-8

Catalog Number:

AG00AR9Y

Molecular Formula:

C12H18BNO4S

Molecular Weight:

283.1516

Catalog Number:

AG00AR9Y

Chemical Name:

(3,5-diMethyl-4-(pyrrolidin-1-ylsulfonyl)phenyl)boronic acid

CAS Number:

1704066-99-8

Molecular Formula:

C12H18BNO4S

Molecular Weight:

283.1516

MDL Number:

MFCD28384278

IUPAC Name:

(3,5-dimethyl-4-pyrrolidin-1-ylsulfonylphenyl)boronic acid

InChI:

InChI=1S/C12H18BNO4S/c1-9-7-11(13(15)16)8-10(2)12(9)19(17,18)14-5-3-4-6-14/h7-8,15-16H,3-6H2,1-2H3

InChI Key:

HCBGRLKZHUJREJ-UHFFFAOYSA-N

SMILES:

Cc1cc(cc(c1S(=O)(=O)N1CCCC1)C)B(O)O

Complexity:

390

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

283.105g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

283.149g/mol

Monoisotopic Mass:

283.105g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

86.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: