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N-Fmoc-N-(2,2,2-trifluoroethyl)glycine

HCID 78993459
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
1486953-68-7
Standard SMILES
O=C(O)CN(CC(F)(F)F)C(=O)OCC1c2ccccc2-c2ccccc21
InChIKey
XRLGIXQTAKEMSI-UHFFFAOYSA-N
Molecular formula
C19H16F3NO4
Average molar mass
379.3 g/mol
Monoisotopic mass
379.10314248

Names & identifiers

Preferred name
N-Fmoc-N-(2,2,2-trifluoroethyl)glycine
IUPAC
2-[9H-fluoren-9-ylmethoxycarbonyl(2,2,2-trifluoroethyl)amino]acetic acid
English name
N-Fmoc-N-(2,2,2-trifluoroethyl)glycine
Molecular formula
C19H16F3NO4
Molecular weight
379.33

Names & synonyms

1486953-68-7N-Fmoc-N-(2,2,2-trifluoroethyl)glycine2-{[(9H-fluoren-9-ylmethoxy)carbonyl](2,2,2-trifluoroethyl)amino}acetic acid2-({[(9h-fluoren-9-yl)methoxy]carbonyl}(2,2,2-trifluoroethyl)amino)acetic acid2-[9H-fluoren-9-ylmethoxycarbonyl(2,2,2-trifluoroethyl)amino]acetic acidMFCD21647512N-(((9H-FLUOREN-9-YL)METHOXY)CARBONYL)-N-(2,2,2-TRIFLUOROETHYL)GLYCINELJC95368Fmoc-Gly(2,2,2-trifluoroethyl)-OHAKOS017496559EN300-81360F80622
Show more names
N-Fmoc-Gly(2,2,2-trifluoroethyl)-OHGlycine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-N-(2,2,2-trifluoroethyl)-
F981568

Database identifiers

CAS
1486953-68-7
PubChem CID
78993459

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
66.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
27
Formal charge
0
Complexity
532

Physicochemical properties

Boiling point
505.7 · 505.7±50.0 °C(Predicted)
Density
1.386 · 1.386±0.06 g/cm3(Predicted)
pka
3.65 · 3.65±0.10(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Suppliers12 total

江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
吉尔生化(玉门)有限公司18221406464 18221406464;13236395639 · [email protected]
上海吉尔多肽有限公司+86-21-61263310 13764994101 · [email protected]
上海英奇曼化学科技有限公司18299177127 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
吉尔多肽生物制药(大连市)有限公司021-61263455 13167021076 · [email protected]
上海吉奉生物科技有限公司021-61263377 15023907684 · [email protected]
滨海吉尔多肽有限公司021-61263389 13524856427 · [email protected]
上海合纯医药科技有限公司021-021-64502386 18017349250 · [email protected]
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]
上海相辉医药科技有限公司13611835272 13611835272 · [email protected]

Related reactions

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Compound notes

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EC Number
196-581-4