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Name |
4-(Boc-amino)benzoic acid |
EINECS | -0 |
CAS No. | 66493-39-8 | Density | 1.242 g/cm3 |
PSA | 75.63000 | LogP | 2.80480 |
Solubility | 1mmol in 2mL DMF | Melting Point |
~200 °C (dec.) |
Formula | C12H15 N O4 | Boiling Point | 336.2 °C at 760 mmHg |
Molecular Weight | 237.255 | Flash Point | 157.1 °C |
Transport Information | N/A | Appearance | white - off-white powder |
Safety | 22-24/25 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | R36/37/38:Irritating to eyes, respiratory system and skin.; | |
Synonyms |
4-(N-tert-Butoxycarbonyl)aminobenzoicacid; 4-(tert-Butoxycarbonylamino)benzoic acid; p-(tert-Butoxycarbonylamino)benzoicacid |
Article Data | 72 |
Molecular Formula: C12H15NO4
Molar mass: 237.2518 g/mol
Density: 1.242 g/cm3
Flash Point: 157.1 °C
Index of Refraction: 1.574
Boiling Point: 336.2 °C at 760 mmHg
Vapour Pressure: 4.48E-05 mmHg at 25°C
Melting point: ~200 °C (dec.)
Storage temp: 2-8°C
Structure of Boc-4-abz-oh (66493-39-8):
Product categories of Amino-naphthalen-1-yl-acetic acid (97611-60-4): Benzene series;Amino Acids
XLogP3-AA: 2.7
H-Bond Donor: 2
H-Bond Acceptor: 4
SMILES: O=C(OC(C)(C)C)Nc1ccc(cc1)C(=O)O
InChI: InChI=1/C12H15NO4/c1-12(2,3)17-11(16)13-9-6-4-8(5-7-9)10(14)15/h4-7H,1-3H3,(H,13,16)(H,14,15)
InChIKey: ZJDBQMWMDZEONW-UHFFFAOYAA
Std. InChI: InChI=1S/C12H15NO4/c1-12(2,3)17-11(16)13-9-6-4-8(5-7-9)10(14)15/h4-7H,1-3H3,(H,13,16)(H,14,15)
Std. InChIKey: ZJDBQMWMDZEONW-UHFFFAOYSA-N
Risk Statements:
36: Irritating to the eyes
37: Irritating to the respiratory system
38: Irritating to the skin
Safety Statements:
22: Do not breathe dust
24: Avoid contact with skin
25: Avoid contact with eyes
Boc-4-abz-oh (66493-39-8) is amino acids which also can be called for Benzoic acid, 4-[[(1,1-dimethylethoxy)carbonyl]amino]- ; 4-[(Tert-butoxycarbonyl)amino]benzoic acid ; N-boc-4-aminobenzoic acid ; N-tert-butoxycarbonyl-4-aminobenzoic acid ; 4-(Boc-amino)benzoic acid ; 4-Tert-butoxycarbonylamino-benzoic acid .