CS-0978709
5-(tert-Butoxycarbonyl)-3-chloro-4,5,6,7,8,9-hexahydropyrazolo[1,5-a][1,4]diazocine-2-carboxylic acid
Manufacturer: ChemScene
CAS Number: 3024070-71-8
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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
C₁₄H₂₀ClN₃O₄
Molecular Weight
329.78
Synonyms
None
SMILES
O=C(O)C1=NN2C(=C1Cl)CN(C(=O)OC(C)(C)C)CCCC2
Tpsa
84.66
Logp
2.7656
H Acceptors
5
H Donors
1
Rotatable Bonds
1
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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: C₁₄H₂₀ClN₃O₄
Molecular Weight: 329.78
Synonyms: None
SMILES: O=C(O)C1=NN2C(=C1Cl)CN(C(=O)OC(C)(C)C)CCCC2
Tpsa: 84.66
Logp: 2.7656
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₂₀ClN₃O₄
Molecular Weight:
329.78
Synonyms:
None
SMILES:
O=C(O)C1=NN2C(=C1Cl)CN(C(=O)OC(C)(C)C)CCCC2
Tpsa:
84.66
Logp:
2.7656
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₉N₃O₂
Molecular Weight: 167.17
Synonyms: None
SMILES: O=CC=1C(=NC=NC1NC)OC
Tpsa: 64.11
Logp: 0.3394
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₉N₃O₂
Molecular Weight:
167.17
Synonyms:
None
SMILES:
O=CC=1C(=NC=NC1NC)OC
Tpsa:
64.11
Logp:
0.3394
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₆N₂O₂
Molecular Weight: 184.24
Synonyms: None
SMILES: O=C1NC2(CNCCC2)C(CO)C1
Tpsa: 61.36
Logp: -0.763
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₆N₂O₂
Molecular Weight:
184.24
Synonyms:
None
SMILES:
O=C1NC2(CNCCC2)C(CO)C1
Tpsa:
61.36
Logp:
-0.763
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₂ClFN₂O₂
Molecular Weight: 234.66
Synonyms: None
SMILES: COC(C1=C(C([C@H](N)C)=CC=N1)F)=O.Cl
Tpsa: 65.21
Logp: 1.4488
H Acceptors: 4
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:
C₉H₁₂ClFN₂O₂
Molecular Weight:
234.66
Synonyms:
None
SMILES:
COC(C1=C(C([C@H](N)C)=CC=N1)F)=O.Cl
Tpsa:
65.21
Logp:
1.4488
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2