CS-0876529
Ethyl (s)-2-acetamido-3-(4-hydroxy-3,5-dinitrophenyl)propanoate
Manufacturer: ChemScene
CAS Number: 29358-99-4
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₃H₁₅N₃O₈
Molecular Weight
341.27
Synonyms
None
SMILES
CCOC(=O)[C@H](CC1=CC(=C(C(=C1)[N+](=O)[O-])O)[N+](=O)[O-])NC(=O)C
Tpsa
161.91
Logp
0.8189
H Acceptors
8
H Donors
2
Rotatable Bonds
7
Related Products
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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₅N₃O₈
Molecular Weight: 341.27
Synonyms: None
SMILES: CCOC(=O)[C@H](CC1=CC(=C(C(=C1)[N+](=O)[O-])O)[N+](=O)[O-])NC(=O)C
Tpsa: 161.91
Logp: 0.8189
H Acceptors: 8
H Donors: 2
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₅N₃O₈
Molecular Weight:
341.27
Synonyms:
None
SMILES:
CCOC(=O)[C@H](CC1=CC(=C(C(=C1)[N+](=O)[O-])O)[N+](=O)[O-])NC(=O)C
Tpsa:
161.91
Logp:
0.8189
H Acceptors:
8
H Donors:
2
Rotatable Bonds:
7
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₂₁NO₇S
Molecular Weight: 275.32
Synonyms: None
SMILES: C[N+](CCO)(CCO)CCO.COS(=O)(=O)[O-]
Tpsa: 127.12
Logp: -2.4971
H Acceptors: 7
H Donors: 3
Rotatable Bonds: 7
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₂₁NO₇S
Molecular Weight:
275.32
Synonyms:
None
SMILES:
C[N+](CCO)(CCO)CCO.COS(=O)(=O)[O-]
Tpsa:
127.12
Logp:
-2.4971
H Acceptors:
7
H Donors:
3
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₆F₅NO
Molecular Weight: 275.17
Synonyms: None
SMILES: C1=CC(=CC(=C1)OC2=C(C(=C(C(=C2F)F)F)F)F)N
Tpsa: 35.25
Logp: 3.7566
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₆F₅NO
Molecular Weight:
275.17
Synonyms:
None
SMILES:
C1=CC(=CC(=C1)OC2=C(C(=C(C(=C2F)F)F)F)F)N
Tpsa:
35.25
Logp:
3.7566
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₂N₂O₂
Molecular Weight: 180.20
Synonyms: None
SMILES: O=C(CCCCC1=NC=CN=C1)O
Tpsa: 63.08
Logp: 0.8839
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₂N₂O₂
Molecular Weight:
180.20
Synonyms:
None
SMILES:
O=C(CCCCC1=NC=CN=C1)O
Tpsa:
63.08
Logp:
0.8839
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
4