Name: Name:2-amino-3-(2H-1,3-benzodioxol-5-yl)propanoic acid
Brand: Angene
SKU: AG01A91X
Rating: 90 (10 reviews)

2-amino-3-(2H-1,3-benzodioxol-5-yl)propanoic acid

CAS No.:

33522-63-3

Catalog Number:

AG01A91X

Molecular Formula:

C10H11NO4

Molecular Weight:

209.1986

Catalog Number:

AG01A91X

Chemical Name:

2-amino-3-(2H-1,3-benzodioxol-5-yl)propanoic acid

CAS Number:

33522-63-3

Molecular Formula:

C10H11NO4

Molecular Weight:

209.1986

MDL Number:

MFCD00666081

IUPAC Name:

2-amino-3-(1,3-benzodioxol-5-yl)propanoic acid

InChI:

InChI=1S/C10H11NO4/c11-7(10(12)13)3-6-1-2-8-9(4-6)15-5-14-8/h1-2,4,7H,3,5,11H2,(H,12,13)

InChI Key:

XHBLRJRZRFZSGW-UHFFFAOYSA-N

SMILES:

OC(=O)C(Cc1ccc2c(c1)OCO2)N

Complexity:

246

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

209.069g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

209.201g/mol

Monoisotopic Mass:

209.069g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

81.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-1.4