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3-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-3-(thiophen-2-yl)propanoic acid

HCID 24902259
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Basic information

CAS
282525-12-6
Standard SMILES
O=C(O)CC(NC(=O)OCC1c2ccccc2-c2ccccc21)c1cccs1
InChIKey
OTFVOIGWAZDVSI-UHFFFAOYSA-N
Molecular formula
C22H19NO4S
Average molar mass
393.5 g/mol
Monoisotopic mass
393.10347926

Names & identifiers

Preferred name
3-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-3-(thiophen-2-yl)propanoic acid
IUPAC
3-(9H-fluoren-9-ylmethoxycarbonylamino)-3-thiophen-2-ylpropanoic acid
English name
FMOC-3-AMINO-3-(2-THIENYL)PROPIONIC ACID
Molecular formula
C22H19NO4S
Molecular weight
393.46

Names & synonyms

282525-12-63-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(thiophen-2-yl)propanoic acid3-({[(9H-FLUOREN-9-YL)METHOXY]CARBONYL}AMINO)-3-(THIOPHEN-2-YL)PROPANOIC ACIDRefChem:487852100-582-73-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-3-(thiophen-2-yl)propanoic acidFmoc-3-amino-3-(2-thienyl)-propionic acid3-(9H-fluoren-9-ylmethoxycarbonylamino)-3-thiophen-2-ylpropanoic acid(3S)-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-(thiophen-2-yl)propanoic acidHLA52512HVA47208MFCD01863207
Show more names
RARECHEM AK HF S196FMOC-3-AMINO-3-(2-THIENYL)PROPIONIC ACIDFMOC-DL-3-(THIOPHENE-2-YL)-3-AMINO-PROPIONIC ACID2-Thiophenepropanoic acid, β-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-
AB15303AB15379SY412248DB-071306CS-02620583-(Fmoc-amino)-3-(2-thienyl)propanoic AcidEN300-81108Fmoc-(R)-3-Amino-3-(2-furyl)propionic acid

Database identifiers

CAS
282525-12-6
PubChem CID
24902259
EC Number
100-582-7

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
104 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
28
Formal charge
0
Complexity
549

Physicochemical properties

Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338
HazardClass
IRRITANT

Safety & regulation

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

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

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

Related reactions

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Compound notes

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