2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanoic acid

HCID 100108
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Basic information

CAS
35661-38-2
Standard SMILES
CC(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O
InChIKey
QWXZOFZKSQXPDC-UHFFFAOYSA-N
Molecular formula
C18H17NO4
Average molar mass
311.3 g/mol
Monoisotopic mass
311.11575802

Names & identifiers

Preferred name
2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanoic acid
IUPAC
2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid
English name
Fmoc-DL-Ala-OH
Molecular formula
C18H17NO4
Molecular weight
311.33

Names & synonyms

2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)propanoic acid2-({[(9H-FLUOREN-9-YL)METHOXY]CARBONYL}AMINO)PROPANOIC ACID2-([[(9H-Fluoren-9-yl)methoxy]carbonyl]amino)propanoic acidRefChem:446666822-677-9Fmoc-DL-Ala-OH35661-38-2Fmoc-DL-alanine2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acidFmoc-Ala-OH (U-13C3, U-15N)MFCD01456463N-Fmoc-DL-alanine
Show more names
(9H-Fluoren-9-yl)MethOxy]Carbonyl DL-Ala-OHAlanine,N-[(9H-fluoren-9-ylmethoxy)carbonyl]-
(((9H-Fluoren-9-yl)methoxy)carbonyl)alanine284665-07-2N-alpha-FMOC-L-ALANINEFmoc-Ala-OH (1-13C)Fmoc-Ala-OH (2-13C)L-ALANINE-3,3,3-D3-N-FMOCFmoc-DL-AlaL-ALANINE-2-D1-N-FMOC

Database identifiers

CAS
35661-38-2、35661-39-3
PubChem CID
100108
DTXSID
DTXSID20275950
ChEMBL
CHEMBL46758
UNII
24GJ6THF44
EC Number
822-677-9
Nikkaji
J1.284.520K、J1.468.895A

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
75.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
23

Physicochemical properties

Melting point
138.2 · 138.2-139.7 °C
Boiling point
544.1 · 544.1±33.0 °C(Predicted)
Density
1.282 · 1.282±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C
pka
3.91 · 3.91±0.10(Predicted)
form
Solid

Safety & regulation

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 statements
H335-H315-H319-H302
Precautionary statements
P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501

Chemistry & industry

Applications

UsesFmoc-DL-Ala-OH (FMOC-DL-Alanine) is a Fmoc protected alanine derivative[1].

Suppliers46 total

江苏吉泰肽业科技有限公司051580855088 18762539991 · [email protected]
盐城通铭生物科技有限公司15195160625 · [email protected]
江苏生康迈翔科技有限公司18217475093 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

Related reactions

4 records
New reaction record

Compound notes

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