CS-0113304
Ponceau 3R
Manufacturer: ChemScene
CAS Number: 3564-09-8
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Purity
98%
MDL No
MFCD00036432
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₉H₁₆N₂Na₂O₇S₂
Molecular Weight
494.45
Synonyms
None
SMILES
O=S(C1=C(O)C(/N=N/C2=CC(C)=C(C)C=C2C)=C3C=CC(S(=O)(O[Na])=O)=CC3=C1)(O[Na])=O
Tpsa
131.69
Logp
3.46366
H Acceptors
9
H Donors
1
Rotatable Bonds
6
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 3564-09-8 | Ponceau 3R | A2B Chem | ₹ 17,026.44 |
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SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501
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Purity: 98%
MDL No: MFCD00036432
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₁₆N₂Na₂O₇S₂
Molecular Weight: 494.45
Synonyms: None
SMILES: O=S(C1=C(O)C(/N=N/C2=CC(C)=C(C)C=C2C)=C3C=CC(S(=O)(O[Na])=O)=CC3=C1)(O[Na])=O
Tpsa: 131.69
Logp: 3.46366
H Acceptors: 9
H Donors: 1
Rotatable Bonds: 6
Purity:
98%
MDL No:
MFCD00036432
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₁₆N₂Na₂O₇S₂
Molecular Weight:
494.45
Synonyms:
None
SMILES:
O=S(C1=C(O)C(/N=N/C2=CC(C)=C(C)C=C2C)=C3C=CC(S(=O)(O[Na])=O)=CC3=C1)(O[Na])=O
Tpsa:
131.69
Logp:
3.46366
H Acceptors:
9
H Donors:
1
Rotatable Bonds:
6
Purity: 98%
MDL No: MFCD00043999
Storage: 4°C, protect from light, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₅N₃S₂
Molecular Weight: 207.28
Synonyms: Thiocyanic acid, 2-amino-6-benzothiazolyl ester
SMILES: N#CSC1=CC=C2N=C(N)SC2=C1
Tpsa: 62.7
Logp: 2.45168
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD00043999
Storage:
4°C, protect from light, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₅N₃S₂
Molecular Weight:
207.28
Synonyms:
Thiocyanic acid, 2-amino-6-benzothiazolyl ester
SMILES:
N#CSC1=CC=C2N=C(N)SC2=C1
Tpsa:
62.7
Logp:
2.45168
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
1
Purity: 97%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₃H₂₂F₆N₄O₃
Molecular Weight: 516.44
Synonyms: Aprepitant USP RC A
SMILES: O=C1NNC(CN2[C@@H](C3=CC=CC=C3)[C@@H](O[C@@H](C4=CC(C(F)(F)F)=CC(C(F)(F)F)=C4)C)OCC2)=N1
Tpsa: 83.24
Logp: 4.813
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 6
Purity:
97%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₃H₂₂F₆N₄O₃
Molecular Weight:
516.44
Synonyms:
Aprepitant USP RC A
SMILES:
O=C1NNC(CN2[C@@H](C3=CC=CC=C3)[C@@H](O[C@@H](C4=CC(C(F)(F)F)=CC(C(F)(F)F)=C4)C)OCC2)=N1
Tpsa:
83.24
Logp:
4.813
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
6
Purity: 98%
MDL No: MFCD00024661
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₁₇N₃O₇
Molecular Weight: 387.34
Synonyms: 4-Nitrophenyl N-[(benzyloxy)carbonyl]-L-asparaginate
SMILES: O=C(N)C[C@@H](C(OC1=CC=C([N+]([O-])=O)C=C1)=O)NC(OCC2=CC=CC=C2)=O
Tpsa: 150.86
Logp: 1.6706
H Acceptors: 7
H Donors: 2
Rotatable Bonds: 8
Purity:
98%
MDL No:
MFCD00024661
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₁₇N₃O₇
Molecular Weight:
387.34
Synonyms:
4-Nitrophenyl N-[(benzyloxy)carbonyl]-L-asparaginate
SMILES:
O=C(N)C[C@@H](C(OC1=CC=C([N+]([O-])=O)C=C1)=O)NC(OCC2=CC=CC=C2)=O
Tpsa:
150.86
Logp:
1.6706
H Acceptors:
7
H Donors:
2
Rotatable Bonds:
8