CS-1078895
(3-(Methoxycarbonyl)-5-oxo-2,3,5,8,9,9a-hexahydro-1H-pyrrolo[1,2-a]azepin-7-yl)boronic acid
Manufacturer: ChemScene
CAS Number: 2916420-82-9
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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
C₁₁H₁₆BNO₅
Molecular Weight
253.06
Synonyms
None
SMILES
O=C1C=C(B(O)O)CCC2N1C(C(=O)OC)CC2
Tpsa
87.07
Logp
-0.7488
H Acceptors
5
H Donors
2
Rotatable Bonds
2
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: C₁₁H₁₆BNO₅
Molecular Weight: 253.06
Synonyms: None
SMILES: O=C1C=C(B(O)O)CCC2N1C(C(=O)OC)CC2
Tpsa: 87.07
Logp: -0.7488
H Acceptors: 5
H Donors: 2
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:
C₁₁H₁₆BNO₅
Molecular Weight:
253.06
Synonyms:
None
SMILES:
O=C1C=C(B(O)O)CCC2N1C(C(=O)OC)CC2
Tpsa:
87.07
Logp:
-0.7488
H Acceptors:
5
H Donors:
2
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: C₁₁H₁₅NO₄
Molecular Weight: 225.24
Synonyms: None
SMILES: C(OC)(=O)[C@H]1N2[C@](CC1)(CCC(=O)CC2=O)[H]
Tpsa: 63.68
Logp: 0.272
H Acceptors: 4
H Donors: 0
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:
C₁₁H₁₅NO₄
Molecular Weight:
225.24
Synonyms:
None
SMILES:
C(OC)(=O)[C@H]1N2[C@](CC1)(CCC(=O)CC2=O)[H]
Tpsa:
63.68
Logp:
0.272
H Acceptors:
4
H Donors:
0
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: C₁₁H₁₇NO₄
Molecular Weight: 227.26
Synonyms: None
SMILES: C(OC)(=O)[C@H]1N2[C@](CC1)(CCC(O)CC2=O)[H]
Tpsa: 66.84
Logp: 0.0638
H Acceptors: 4
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:
C₁₁H₁₇NO₄
Molecular Weight:
227.26
Synonyms:
None
SMILES:
C(OC)(=O)[C@H]1N2[C@](CC1)(CCC(O)CC2=O)[H]
Tpsa:
66.84
Logp:
0.0638
H Acceptors:
4
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: C₉H₇BrN₂O₂
Molecular Weight: 255.07
Synonyms: None
SMILES: O=C(O)CC1=CNC=2C=NC=C(Br)C21
Tpsa: 65.98
Logp: 1.9525
H Acceptors: 2
H Donors: 2
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:
C₉H₇BrN₂O₂
Molecular Weight:
255.07
Synonyms:
None
SMILES:
O=C(O)CC1=CNC=2C=NC=C(Br)C21
Tpsa:
65.98
Logp:
1.9525
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
2