Fmoc-D-ser-oh

C₁₈H₁₇NO₅CAS 116861-26-8327.34 g/mol

Open in Covalent MOL file

Alcohol Carbamate Carboxylic acid

Properties

Molecular formula: C₁₈H₁₇NO₅
Molar mass: 327.34 g/mol
Exact mass: 327.1107 Da
logP: 1.97Crippen estimate
Polar surface area: 95.9 Å²
H-bond donors / acceptors: 3 / 4
Rotatable bonds: 5
Stereocentres: Rin SMILES atom order

Hazards

Warning

H302 Harmful if swallowed50% of notifiers
H312 Harmful in contact with skin50% of notifiers
H315 Causes skin irritation50% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled50% of notifiers
H335 May cause respiratory irritation50% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

116861-26-8

SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@H](CO)C(=O)O

InChIKey

JZTKZVJMSCONAK-MRXNPFEDSA-N

InChI

InChI=1S/C18H17NO5/c20-9-16(17(21)22)19-18(23)24-10-15-13-7-3-1-5-11(13)12-6-2-4-8-14(12)15/h1-8,15-16,20H,9-10H2,(H,19,23)(H,21,22)/t16-/m1/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with Fmoc-D-ser-oh

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Fmoc-L-serine73724-45-5Enantiomer

Similar compounds

(2S)-2-(9H-Fluoren-9-ylmethoxycarbonylamino)butanoic acid135112-27-576 % similar Fmoc-D-abu-oh170642-27-076 % similar Fmoc-dap(fmoc)-oh201473-90-776 % similar Fmoc-L-aspartic acid119062-05-474 % similar Fmoc-L-norvaline135112-28-674 % similar Fmoc-D-asp-oh136083-57-374 % similar (2R)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)pentanoic acid144701-24-674 % similar Fmoc-phe-oh286460-71-774 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Tranilast53902-12-8 Tranilast53902-17-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook