CS-0008317
2-[(N-tert-Butoxycarbonyl)amino]-4-(4-chlorophenyl)-3-(3-cyanophenyl)butane
Manufacturer: ChemScene
CAS Number: 605680-53-3
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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
C₂₂H₂₅ClN₂O₂
Molecular Weight
384.90
Synonyms
YKBJDPDJEMNANR-UHFFFAOYSA-N
SMILES
N#CC1=CC(C(CC2=CC=C(Cl)C=C2)C(C)NC(OC(C)(C)C)=O)=CC=C1
Tpsa
62.12
Logp
5.45118
H Acceptors
3
H Donors
1
Rotatable Bonds
5
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 605680-53-3 | 2-[(N-tert-Butoxycarbonyl)amino]-4-(4-chlorophenyl)-3-(3-cyanophenyl)butane | A2B Chem | -- |
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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-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: C₂₂H₂₅ClN₂O₂
Molecular Weight: 384.90
Synonyms: YKBJDPDJEMNANR-UHFFFAOYSA-N
SMILES: N#CC1=CC(C(CC2=CC=C(Cl)C=C2)C(C)NC(OC(C)(C)C)=O)=CC=C1
Tpsa: 62.12
Logp: 5.45118
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₂₅ClN₂O₂
Molecular Weight:
384.90
Synonyms:
YKBJDPDJEMNANR-UHFFFAOYSA-N
SMILES:
N#CC1=CC(C(CC2=CC=C(Cl)C=C2)C(C)NC(OC(C)(C)C)=O)=CC=C1
Tpsa:
62.12
Logp:
5.45118
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: MFCD12198685
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₈N₂O₂
Molecular Weight: 198.26
Synonyms: Carbamic acid, 3-azabicyclo[3.1.0]hex-1-yl-, 1,1-dimethylethyl ester (9CI)
SMILES: O=C(OC(C)(C)C)NC1(C2)C2CNC1
Tpsa: 50.36
Logp: 0.873
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD12198685
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₈N₂O₂
Molecular Weight:
198.26
Synonyms:
Carbamic acid, 3-azabicyclo[3.1.0]hex-1-yl-, 1,1-dimethylethyl ester (9CI)
SMILES:
O=C(OC(C)(C)C)NC1(C2)C2CNC1
Tpsa:
50.36
Logp:
0.873
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
1
Purity: 98%
MDL No: MFCD00008745
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₀O₂
Molecular Weight: 150.17
Synonyms: None
SMILES: O=C(C)C1=CC=C(C=C1)OC
Tpsa: 26.3
Logp: 1.8978
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD00008745
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₀O₂
Molecular Weight:
150.17
Synonyms:
None
SMILES:
O=C(C)C1=CC=C(C=C1)OC
Tpsa:
26.3
Logp:
1.8978
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD00002511
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₈O₃
Molecular Weight: 152.15
Synonyms: 3-Hydroxy-4-methylbenzoic acid
SMILES: O=C(O)C1=CC=C(C)C(O)=C1
Tpsa: 57.53
Logp: 1.39882
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD00002511
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₈O₃
Molecular Weight:
152.15
Synonyms:
3-Hydroxy-4-methylbenzoic acid
SMILES:
O=C(O)C1=CC=C(C)C(O)=C1
Tpsa:
57.53
Logp:
1.39882
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
1