CS-0457604
2,2A,3,4,7,8b-hexahydronaphtho[1,2-b]azet-8(1H)-one
Manufacturer: ChemScene
CAS Number: 874292-66-7
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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
C₁₁H₁₃NO
Molecular Weight
175.23
Synonyms
(1S,6S)-4,5-BENZO-7-AZABICYCLO[4.2.0]OCTAN-8-ONE
SMILES
O=C1CC=CC2=C1C3NCC3CC2
Tpsa
29.1
Logp
1.1938
H Acceptors
2
H Donors
1
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: C₁₁H₁₃NO
Molecular Weight: 175.23
Synonyms: (1S,6S)-4,5-BENZO-7-AZABICYCLO[4.2.0]OCTAN-8-ONE
SMILES: O=C1CC=CC2=C1C3NCC3CC2
Tpsa: 29.1
Logp: 1.1938
H Acceptors: 2
H Donors: 1
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:
C₁₁H₁₃NO
Molecular Weight:
175.23
Synonyms:
(1S,6S)-4,5-BENZO-7-AZABICYCLO[4.2.0]OCTAN-8-ONE
SMILES:
O=C1CC=CC2=C1C3NCC3CC2
Tpsa:
29.1
Logp:
1.1938
H Acceptors:
2
H Donors:
1
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: C₂₀H₂₅BN₂O₄
Molecular Weight: 368.23
Synonyms: N-(4-methoxyphenyl)-N'-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]Urea
SMILES: O=C(NC1=CC=C(B2OC(C)(C)C(C)(C)O2)C=C1)NC3=CC=C(OC)C=C3
Tpsa: 68.82
Logp: 3.6384
H Acceptors: 4
H Donors: 2
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:
C₂₀H₂₅BN₂O₄
Molecular Weight:
368.23
Synonyms:
N-(4-methoxyphenyl)-N'-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]Urea
SMILES:
O=C(NC1=CC=C(B2OC(C)(C)C(C)(C)O2)C=C1)NC3=CC=C(OC)C=C3
Tpsa:
68.82
Logp:
3.6384
H Acceptors:
4
H Donors:
2
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: C₁₇H₂₁BN₄O₃
Molecular Weight: 340.18
Synonyms: None
SMILES: O=C(NC1=CC=C(B2OC(C)(C)C(C)(C)O2)C=C1)NC3=NC=CC=N3
Tpsa: 85.37
Logp: 2.4198
H Acceptors: 5
H Donors: 2
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:
C₁₇H₂₁BN₄O₃
Molecular Weight:
340.18
Synonyms:
None
SMILES:
O=C(NC1=CC=C(B2OC(C)(C)C(C)(C)O2)C=C1)NC3=NC=CC=N3
Tpsa:
85.37
Logp:
2.4198
H Acceptors:
5
H Donors:
2
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: C₁₇H₂₅BN₂O₃S
Molecular Weight: 348.27
Synonyms: None
SMILES: O=C(N1CCSCC1)NC2=CC=C(B3OC(C)(C)C(C)(C)O3)C=C2
Tpsa: 50.8
Logp: 2.5665
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:
C₁₇H₂₅BN₂O₃S
Molecular Weight:
348.27
Synonyms:
None
SMILES:
O=C(N1CCSCC1)NC2=CC=C(B3OC(C)(C)C(C)(C)O3)C=C2
Tpsa:
50.8
Logp:
2.5665
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2