CS-0664684
2-Benzyl 1-ethyl (1s,3ar,6as)-4-oxohexahydrocyclopenta[c]pyrrole-1,2(1h)-dicarboxylate
Manufacturer: ChemScene
CAS Number: 402958-21-8
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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
C₁₈H₂₁NO₅
Molecular Weight
331.36
Synonyms
None
SMILES
CCOC(=O)[C@@H]1[C@H]2CCC(=O)[C@H]2CN1C(=O)OCC3=CC=CC=C3
Tpsa
72.91
Logp
2.1658
H Acceptors
5
H Donors
0
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-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: C₁₈H₂₁NO₅
Molecular Weight: 331.36
Synonyms: None
SMILES: CCOC(=O)[C@@H]1[C@H]2CCC(=O)[C@H]2CN1C(=O)OCC3=CC=CC=C3
Tpsa: 72.91
Logp: 2.1658
H Acceptors: 5
H Donors: 0
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:
C₁₈H₂₁NO₅
Molecular Weight:
331.36
Synonyms:
None
SMILES:
CCOC(=O)[C@@H]1[C@H]2CCC(=O)[C@H]2CN1C(=O)OCC3=CC=CC=C3
Tpsa:
72.91
Logp:
2.1658
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: MFCD21496274
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₁₃NO₃
Molecular Weight: 147.17
Synonyms: None
SMILES: CCC[C@@H](C(C(=O)O)O)N
Tpsa: 83.55
Logp: -0.4407
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 4
Purity:
98%
MDL No:
MFCD21496274
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₁₃NO₃
Molecular Weight:
147.17
Synonyms:
None
SMILES:
CCC[C@@H](C(C(=O)O)O)N
Tpsa:
83.55
Logp:
-0.4407
H Acceptors:
3
H Donors:
3
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: C₁₄H₁₉NO₅
Molecular Weight: 281.30
Synonyms: None
SMILES: CCC[C@@H](C(C(=O)O)O)NC(=O)OCC1=CC=CC=C1
Tpsa: 95.86
Logp: 1.527
H Acceptors: 4
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:
C₁₄H₁₉NO₅
Molecular Weight:
281.30
Synonyms:
None
SMILES:
CCC[C@@H](C(C(=O)O)O)NC(=O)OCC1=CC=CC=C1
Tpsa:
95.86
Logp:
1.527
H Acceptors:
4
H Donors:
3
Rotatable Bonds:
7
Purity: 98%
MDL No: MFCD20723656
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₂N₂
Molecular Weight: 184.24
Synonyms: None
SMILES: C1=CC=C(C=C1)CC2=NC=C(C=C2)N
Tpsa: 38.91
Logp: 2.2546
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD20723656
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₂N₂
Molecular Weight:
184.24
Synonyms:
None
SMILES:
C1=CC=C(C=C1)CC2=NC=C(C=C2)N
Tpsa:
38.91
Logp:
2.2546
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2