CS-0159237
tert-Butyl (1R,4R)-5-oxo-7-azabicyclo[2.2.1]hept-2-ene-7-carboxylate
Manufacturer: ChemScene
CAS Number: 635298-67-8
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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
C₁₁H₁₅NO₃
Molecular Weight
209.24
Synonyms
(1R,4R)-7-(tert-butoxycarbonyl)-7-azabicyclo[2.2.1]hept-5-en-2-one
SMILES
O=C1[C@H]2C=C[C@H](N2C(OC(C)(C)C)=O)C1
Tpsa
46.61
Logp
1.5033
H Acceptors
3
H Donors
0
Rotatable Bonds
0
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: C₁₁H₁₅NO₃
Molecular Weight: 209.24
Synonyms: (1R,4R)-7-(tert-butoxycarbonyl)-7-azabicyclo[2.2.1]hept-5-en-2-one
SMILES: O=C1[C@H]2C=C[C@H](N2C(OC(C)(C)C)=O)C1
Tpsa: 46.61
Logp: 1.5033
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₅NO₃
Molecular Weight:
209.24
Synonyms:
(1R,4R)-7-(tert-butoxycarbonyl)-7-azabicyclo[2.2.1]hept-5-en-2-one
SMILES:
O=C1[C@H]2C=C[C@H](N2C(OC(C)(C)C)=O)C1
Tpsa:
46.61
Logp:
1.5033
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
0
Purity: 95%
MDL No: MFCD09842112
Storage: -20°C, protect from light, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄₁H₅₀N₅O₈P
Molecular Weight: 771.84
Synonyms: None
SMILES: COC1=CC=C(C(C2=CC=C(OC)C=C2)(OC[C@@H]3[C@@H](OP(N(C(C)C)C(C)C)OCCC#N)C[C@H](N4C=CC(NC(C)=O)=NC4=O)O3)C5=CC=CC=C5)C=C1
Tpsa: 146.4
Logp: 7.17628
H Acceptors: 12
H Donors: 1
Rotatable Bonds: 18
Purity:
95%
MDL No:
MFCD09842112
Storage:
-20°C, protect from light, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄₁H₅₀N₅O₈P
Molecular Weight:
771.84
Synonyms:
None
SMILES:
COC1=CC=C(C(C2=CC=C(OC)C=C2)(OC[C@@H]3[C@@H](OP(N(C(C)C)C(C)C)OCCC#N)C[C@H](N4C=CC(NC(C)=O)=NC4=O)O3)C5=CC=CC=C5)C=C1
Tpsa:
146.4
Logp:
7.17628
H Acceptors:
12
H Donors:
1
Rotatable Bonds:
18
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₅NO₃
Molecular Weight: 209.24
Synonyms: (1S,4S)-7-(tert-butoxycarbonyl)-7-azabicyclo[2.2.1]hept-5-en-2-one
SMILES: O=C1[C@@H]2C=C[C@@H](N2C(OC(C)(C)C)=O)C1
Tpsa: 46.61
Logp: 1.5033
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₅NO₃
Molecular Weight:
209.24
Synonyms:
(1S,4S)-7-(tert-butoxycarbonyl)-7-azabicyclo[2.2.1]hept-5-en-2-one
SMILES:
O=C1[C@@H]2C=C[C@@H](N2C(OC(C)(C)C)=O)C1
Tpsa:
46.61
Logp:
1.5033
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
0
Purity: 98+%
MDL No: MFCD24468878
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₇NO₃
Molecular Weight: 223.27
Synonyms: 8-Azabicyclo[3.2.1]oct-6-ene-8-carboxylic acid, 3-oxo-, 1,1-dimethylethyl ester
SMILES: O=C(N(C1C2)C(C=C1)CC2=O)OC(C)(C)C
Tpsa: 46.61
Logp: 1.8934
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 0
Purity:
98+%
MDL No:
MFCD24468878
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₇NO₃
Molecular Weight:
223.27
Synonyms:
8-Azabicyclo[3.2.1]oct-6-ene-8-carboxylic acid, 3-oxo-, 1,1-dimethylethyl ester
SMILES:
O=C(N(C1C2)C(C=C1)CC2=O)OC(C)(C)C
Tpsa:
46.61
Logp:
1.8934
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
0