CAS 73365-02-3 N-(tert-Butoxycarbonyl)-D-prolinal (HCID 7009153)

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Basic information

CAS: 73365-02-3
Standard SMILES: CC(C)(C)OC(=O)N1CCC[C@@H]1C=O
InChIKey: YDBPZCVWPFMBDH-MRVPVSSYSA-N
Molecular formula: C10H17NO3
Average molar mass: 199.25 g/mol
Monoisotopic mass: 199.1208434

Names & identifiers

Preferred name: N-(tert-Butoxycarbonyl)-D-prolinal
IUPAC: tert-butyl (2R)-2-formylpyrrolidine-1-carboxylate
English name: N-(tert-Butoxycarbonyl)-D-prolinal
Molecular formula: C10H17NO3
Molecular weight: 199.25

Names & synonyms

N-(tert-Butoxycarbonyl)-D-prolinalRefChem:828683624-637-4N-Boc-D-Prolinal73365-02-3tert-butyl (2R)-2-formylpyrrolidine-1-carboxylate(R)-tert-butyl 2-formylpyrrolidine-1-carboxylateMFCD01321389tert-butyl (R)-2-formylpyrrolidine-1-carboxylateMFCD00801184Boc- D-Prolinal1-Pyrrolidinecarboxylic acid, 2-formyl-, 1,1-dimethylethyl ester, (2R)-

Show more names

Boc-D-prolyneBOC-D-PROLINALN-T-BOC-D-PROLINAL(R)-N-BOC-PROLINAL, 97+%(R)-1-Boc-2-formylpyrrolidine(R)-(+)-1-BOC-2-PYRROLIDINECARBALDEHYDES-(+)-N-(diphenylmethylene)glycinesultam

(R)-N-Boc-prolinal(2R)-N-BOC-prolinalA837809SCHEMBL338312N-(t-butoxycarbonyl)D-prolinalSCHEMBL7855614N-(t-butoxycarbonyl)-D-prolinalDTXSID40426548

Database identifiers

CAS: 73365-02-3
PubChem CID

Properties

Computed structural properties

XLogP: 1.2
Topological polar surface area: 46.6 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 14
Formal charge: 0
Complexity: 232

Physicochemical properties

Boiling point: 228 °C · 228 °C(lit.)
alpha: 83 ° · +83°(23℃, neat)
Density: 1.059 g/mL · 1.059 g/mL at 25 °C(lit.)
refractive index: 20 · n20/D 1.461(lit.)
Flash point: 230 °F · >230 °F
storage temp.: -20 °C · -20°C
form: Liquid
pka: -3.03 · -3.03±0.40(Predicted)
Specific Gravity: 1.059 · 1.059
color: Colorless to yellow
optical activity: 23 · [α]23/D +83°, neat
Sensitive: Air Sensitive
Major Application: peptide synthesis
InChI: InChI=1S/C10H17NO3/c1-10(2,3)14-9(13)11-6-4-5-8(11)7-12/h7-8H,4-6H2,1-3H3/t8-/m1/s1
InChIKey: YDBPZCVWPFMBDH-MRVPVSSYSA-N
SMILES: N1(C(OC(C)(C)C)=O)CCC[C@@H]1C=O