CS-0887402
Benzyl (1R,2S,5R)-7,7-dimethyl-3-azabicyclo[3.2.0]heptane-2-carboxylate hydrochloride
Manufacturer: ChemScene
CAS Number: 2952552-03-1
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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
C₁₆H₂₂ClNO₂
Molecular Weight
295.80
Synonyms
None
SMILES
O=C([C@@H]1[C@]2([H])[C@@](CN1)([H])CC2(C)C)OCC3=CC=CC=C3.Cl
Tpsa
38.33
Logp
2.7857
H Acceptors
3
H Donors
1
Rotatable Bonds
3
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: C₁₆H₂₂ClNO₂
Molecular Weight: 295.80
Synonyms: None
SMILES: O=C([C@@H]1[C@]2([H])[C@@](CN1)([H])CC2(C)C)OCC3=CC=CC=C3.Cl
Tpsa: 38.33
Logp: 2.7857
H Acceptors: 3
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:
C₁₆H₂₂ClNO₂
Molecular Weight:
295.80
Synonyms:
None
SMILES:
O=C([C@@H]1[C@]2([H])[C@@](CN1)([H])CC2(C)C)OCC3=CC=CC=C3.Cl
Tpsa:
38.33
Logp:
2.7857
H Acceptors:
3
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: C₉H₁₆ClNO₂
Molecular Weight: 205.68
Synonyms: None
SMILES: COC([C@@H]1[C@@H](C2CC2)CCN1)=O.Cl
Tpsa: 38.33
Logp: 0.9693
H Acceptors: 3
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:
C₉H₁₆ClNO₂
Molecular Weight:
205.68
Synonyms:
None
SMILES:
COC([C@@H]1[C@@H](C2CC2)CCN1)=O.Cl
Tpsa:
38.33
Logp:
0.9693
H Acceptors:
3
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: C₉₄H₈₂N₄O₈
Molecular Weight: 1395.68
Synonyms: (E)-TOP-HTM-α2
SMILES: COC1=CC=C(N(C2=CC=C(C=C2)/C=C/C3=C(/C=C/C4=CC=C(N(C5=CC=C(OC)C=C5)C6=CC=C(OC)C=C6)C=C4)C=C(/C=C/C7=CC=C(N(C8=CC=C(OC)C=C8)C9=CC=C(OC)C=C9)C=C7)C(/C=C/C%10=CC=C(N(C%11=CC=C(OC)C=C%11)C%12=CC=C(OC)C=C%12)C=C%10)=C3)C%13=CC=C(OC)C=C%13)C=C1
Tpsa: 86.8
Logp: 24.3162
H Acceptors: 12
H Donors: 0
Rotatable Bonds: 28
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉₄H₈₂N₄O₈
Molecular Weight:
1395.68
Synonyms:
(E)-TOP-HTM-α2
SMILES:
COC1=CC=C(N(C2=CC=C(C=C2)/C=C/C3=C(/C=C/C4=CC=C(N(C5=CC=C(OC)C=C5)C6=CC=C(OC)C=C6)C=C4)C=C(/C=C/C7=CC=C(N(C8=CC=C(OC)C=C8)C9=CC=C(OC)C=C9)C=C7)C(/C=C/C%10=CC=C(N(C%11=CC=C(OC)C=C%11)C%12=CC=C(OC)C=C%12)C=C%10)=C3)C%13=CC=C(OC)C=C%13)C=C1
Tpsa:
86.8
Logp:
24.3162
H Acceptors:
12
H Donors:
0
Rotatable Bonds:
28
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₆ClNO₂
Molecular Weight: 205.68
Synonyms: None
SMILES: COC([C@H]1[C@H](C2CC2)CCN1)=O.Cl
Tpsa: 38.33
Logp: 0.9693
H Acceptors: 3
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:
C₉H₁₆ClNO₂
Molecular Weight:
205.68
Synonyms:
None
SMILES:
COC([C@H]1[C@H](C2CC2)CCN1)=O.Cl
Tpsa:
38.33
Logp:
0.9693
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2