CS-0336780
Rel-(1R,2S)-2-((4-nitrophenyl)carbamoyl)cyclohexane-1-carboxylic acid
Manufacturer: ChemScene
CAS Number: 17716-19-7
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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
C₁₄H₁₆N₂O₅
Molecular Weight
292.29
Synonyms
2-(4-Nitro-phenylcarbamoyl)-cyclohexanecarboxylic acid
SMILES
O=C([C@H]1[C@@H](C(NC2=CC=C([N+]([O-])=O)C=C2)=O)CCCC1)O
Tpsa
109.54
Logp
2.4243
H Acceptors
4
H Donors
2
Rotatable Bonds
4
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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-P271-P280-P302+P352-P304+P340-P305+P351+P338-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: C₁₄H₁₆N₂O₅
Molecular Weight: 292.29
Synonyms: 2-(4-Nitro-phenylcarbamoyl)-cyclohexanecarboxylic acid
SMILES: O=C([C@H]1[C@@H](C(NC2=CC=C([N+]([O-])=O)C=C2)=O)CCCC1)O
Tpsa: 109.54
Logp: 2.4243
H Acceptors: 4
H Donors: 2
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:
C₁₄H₁₆N₂O₅
Molecular Weight:
292.29
Synonyms:
2-(4-Nitro-phenylcarbamoyl)-cyclohexanecarboxylic acid
SMILES:
O=C([C@H]1[C@@H](C(NC2=CC=C([N+]([O-])=O)C=C2)=O)CCCC1)O
Tpsa:
109.54
Logp:
2.4243
H Acceptors:
4
H Donors:
2
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: C₁₅H₁₉NO₄
Molecular Weight: 277.32
Synonyms: 1-(4-ISOPROPOXY-BENZOYL)-PYRROLIDINE-2-CARBOXYLIC ACID
SMILES: CC(C)OC1=CC=C(C=C1)C(=O)N2CCCC2C(=O)O
Tpsa: 66.84
Logp: 2.163
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:
C₁₅H₁₉NO₄
Molecular Weight:
277.32
Synonyms:
1-(4-ISOPROPOXY-BENZOYL)-PYRROLIDINE-2-CARBOXYLIC ACID
SMILES:
CC(C)OC1=CC=C(C=C1)C(=O)N2CCCC2C(=O)O
Tpsa:
66.84
Logp:
2.163
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
4
Purity: 95+%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₂N₂O₅
Molecular Weight: 264.23
Synonyms: 1H-Indole-2-carboxylic acid, 7-methoxy-5-nitro-, ethyl ester
SMILES: CCOC(=O)C1=CC2=CC(=CC(=C2N1)OC)[N+](=O)[O-]
Tpsa: 94.46
Logp: 2.2614
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 4
Purity:
95+%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₂N₂O₅
Molecular Weight:
264.23
Synonyms:
1H-Indole-2-carboxylic acid, 7-methoxy-5-nitro-, ethyl ester
SMILES:
CCOC(=O)C1=CC2=CC(=CC(=C2N1)OC)[N+](=O)[O-]
Tpsa:
94.46
Logp:
2.2614
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
4
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₁NO₄
Molecular Weight: 257.24
Synonyms: Phenyl 1,3-benzodioxol-5-ylcarbamate
SMILES: O=C(OC1=CC=CC=C1)NC2=CC=C(OCO3)C3=C2
Tpsa: 56.79
Logp: 3.0262
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 2
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₁NO₄
Molecular Weight:
257.24
Synonyms:
Phenyl 1,3-benzodioxol-5-ylcarbamate
SMILES:
O=C(OC1=CC=CC=C1)NC2=CC=C(OCO3)C3=C2
Tpsa:
56.79
Logp:
3.0262
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2