(2S)-Isopropyl 2-(((perfluorophenoxy)(phenoxy)phosphoryl)amino)propanoate | CAS No. 1334513-02-8

(2S)-Isopropyl 2-(((perfluorophenoxy)(phenoxy)phosphoryl)amino)propanoate

Basic Information

CAS Number

1334513-02-8

Molecular Formula

C18H17F5NO5P

Molecular Weight

453.3 g/mol

AD

Basic Physical Properties

Boiling Point

442.6±55.0°C at 760 mmHg

CC(C)OC(=O)C(C)NP(=O)(OC1=CC=CC=C1)OC2=C(C(=C(C(=C2F)F)F)F)F

InChI

InChI=1S/C18H17F5NO5P/c1-9(2)27-18(25)10(3)24-30(26,28-11-7-5-4-6-8-11)29-17-15(22)13(20)12(19)14(21)16(17)23/h4-10H,1-3H3,(H,24,26)/t10-,30-/m0/s1

InChIKey

MIILDBHEJQLACD-ZJPIPACBSA-N

LogP

4.877700000000003

Topological Polar Surface Area

73.86 Ų

Hydrogen Bond Donor/Acceptor

1 / 6

Complexity

608

Safety Information

View Safety Information

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral
H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H332 Harmful if inhaled
Acute toxicity, inhalation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

  • N-[(S)-(2,3,4,5,6-pentafluorophenoxy)phenoxyphosphinyl]-L-alanine 1-Methylethyl ester
  • (S)-isopropyl 2-(((S)-(perfluorophenoxy)(phenoxy)phosphoryl)aMino)propanoate
  • (2S)-isopropyl 2-(((perfluorophenoxy)(phenoxy)phosphoryl)aMino)propanoate
  • (S)-2-[(S)-((2,3,4,5,6-pentafluorophenoxy)(phenoxy)phosphoryl)amino]propionic acid isopropyl ester
  • Isopropyl N-[(pentafluorophenoxy)(phenoxy)phosphoryl]-L-alaninate
  • L-Alanine, N-[(S)-(2,3,4,5,6-pentafluorophenoxy)-phenoxyphosphinyl]-, 1-methylethyl ester
  • propan-2-yl (2S)-2-[[(2,3,4,5,6-pentafluorophenoxy)-phenoxyphosphoryl]amino]propanoate
  • (S)-2-[(S)-(2,3,4,5,6-pentafluoro-phenoxy)-phenoxy-phosphorylamino]propionic acid isopropyl ester
  • 2(S)-[((S)-2,3,4,5,6-pentafluoro-phenoxy)-phenoxy-phosphorylamino]propionic acid isopropyl ester
  • propan-2-yl (2S)-2-{[pentafluorophenoxy(phenoxy)phosphoryl]amino}propanoate
  • N-[(S)-(2,3,4,5,6-Pentafluorophenoxy)phenoxyphosphinyl]-L-alanine1-methylethyl ester
  • C18H17F5NO5P
  • MIILDBHEJQLAC
  • Sofosbuvir Intermediate
  • (S)-isopropyl 2-(((S)-(perfluorophenoxy)(phenoxy)phosphoryl)amino)propanoate
  • Isopropyl((R)-(perfluorophenoxy)(phenoxy)phosphoryl)-L-alaninate
  • (2S)-Isopropyl 2-(((perfluorophenoxy)(phenoxy)phosphoryl)amino)propanoate
  • L-Alanine, N-[(2,3,4,5,6-pentafluorophenoxy)phenoxyphosphinyl]-, 1-methylethyl ester
  • L-alanien,N-[(S)-(2,3,4,5,6-Pentafluorophenoxy)-
  • AC-27659
  • 1334513-02-8
  • 1256490-52-4
  • CS-W023252
  • W19451
  • AKOS025289595
  • propan-2-yl (2S)-2-{[(2,3,4,5,6-pentafluorophenoxy)(phenoxy)phosphoryl]amino}propanoate
  • A890065
  • ISOPROPYL ((PERFLUOROPHENOXY)(PHENOXY)PHOSPHORYL)-L-ALANINATE
  • isopropyl ((S)-(perfluorophenoxy)(phenoxy)phosphoryl)-L-alaninate
  • BCP08768
  • Isopropyl (2S)-2-[[(2,3,4,5,6-pentafluorophenoxy)-phenoxy-phosphoryl]amino]propanoate

MDL Number

MFCD22665799

FAQ

What is (2S)-Isopropyl 2-(((perfluorophenoxy)(phenoxy)phosphoryl)amino)propanoate (CAS: 1334513-02-8)?

This compound is a phosphonic acid derivative with a complex structure featuring two phenoxy groups attached to a phosphoryl group, which is connected to an amino group and a propanoate chain. The (2S) configuration indicates a specific stereochemistry. It is known for its potential applications in pharmaceutical and chemical research due to its unique functional groups and reactivity profile.

What are the main uses of (2S)-Isopropyl 2-(((perfluorophenoxy)(phenoxy)phosphoryl)amino)propanoate (CAS: 1334513-02-8)?

This compound is primarily used in pharmaceutical research as a potential inhibitor or modulator of certain biological processes. It may also find applications in organic synthesis and materials science due to its structural versatility and reactivity. Its use in industrial or food sectors is currently limited and requires further investigation.

Is (2S)-Isopropyl 2-(((perfluorophenoxy)(phenoxy)phosphoryl)amino)propanoate (CAS: 1334513-02-8) safe?

Safety data for this compound is limited, but as with many phosphonic acid derivatives, it may exhibit toxicity if mishandled. Proper protective equipment, including gloves and goggles, should be used during handling. It is important to follow established safety protocols and consult regulatory guidelines for safe use and exposure limits.

How should (2S)-Isopropyl 2-(((perfluorophenoxy)(phenoxy)phosphoryl)amino)propanoate (CAS: 1334513-02-8) be stored?

This compound should be stored in a cool, dry, and dark place, away from moisture and air. It is recommended to keep it in a sealed container at a temperature below 25°C. Avoid exposure to light and ensure proper ventilation to maintain stability and prevent degradation.

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