Name: Name:2-{1-[(tert-butoxy)carbonyl]-3-(1-fluoroethenyl)azetidin-3-yl}acetic acid
Brand: Angene
SKU: AG01EM7A
Rating: 90 (10 reviews)

2-{1-[(tert-butoxy)carbonyl]-3-(1-fluoroethenyl)azetidin-3-yl}acetic acid

CAS No.:

2138103-41-8

Catalog Number:

AG01EM7A

Molecular Formula:

C12H18FNO4

Molecular Weight:

259.2740

Catalog Number:

AG01EM7A

Chemical Name:

2-{1-[(tert-butoxy)carbonyl]-3-(1-fluoroethenyl)azetidin-3-yl}acetic acid

CAS Number:

2138103-41-8

Molecular Formula:

C12H18FNO4

Molecular Weight:

259.2740

MDL Number:

MFCD31559440

IUPAC Name:

2-[3-(1-fluoroethenyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]azetidin-3-yl]acetic acid

InChI:

InChI=1S/C12H18FNO4/c1-8(13)12(5-9(15)16)6-14(7-12)10(17)18-11(2,3)4/h1,5-7H2,2-4H3,(H,15,16)

InChI Key:

VXASAPKBJTXORC-UHFFFAOYSA-N

SMILES:

O=C(N1CC(C1)(CC(=O)O)C(=C)F)OC(C)(C)C

Complexity:

380

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

259.122g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

259.277g/mol

Monoisotopic Mass:

259.122g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2