Name: Name:(3S,4S)-1-(2-Ethoxyethyl)-4-(trifluoromethyl)pyrrolidine-3-carboxylic acid
Brand: Angene
SKU: AG0099ML
Rating: 90 (10 reviews)

(3S,4S)-1-(2-Ethoxyethyl)-4-(trifluoromethyl)pyrrolidine-3-carboxylic acid

CAS No.:

1186655-16-2

Catalog Number:

AG0099ML

Molecular Formula:

C10H16F3NO3

Molecular Weight:

255.2341

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Catalog Number:

AG0099ML

Chemical Name:

(3S,4S)-1-(2-Ethoxyethyl)-4-(trifluoromethyl)pyrrolidine-3-carboxylic acid

CAS Number:

1186655-16-2

Molecular Formula:

C10H16F3NO3

Molecular Weight:

255.2341

MDL Number:

MFCD12028193

IUPAC Name:

(3S,4S)-1-(2-ethoxyethyl)-4-(trifluoromethyl)pyrrolidine-3-carboxylic acid

InChI:

InChI=1S/C10H16F3NO3/c1-2-17-4-3-14-5-7(9(15)16)8(6-14)10(11,12)13/h7-8H,2-6H2,1H3,(H,15,16)/t7-,8-/m1/s1

InChI Key:

VWKJBJKCLHPFLX-HTQZYQBOSA-N

SMILES:

CCOCCN1C[C@H]([C@@H](C1)C(F)(F)F)C(=O)O

Complexity:

270

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

255.108g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

255.237g/mol

Monoisotopic Mass:

255.108g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

49.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-1.1