CS-0130681
tert-Butyl (8-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3,4,5-tetrahydrobenzo[b]oxepin-5-yl)carbamate
Manufacturer: ChemScene
CAS Number: 2412760-61-1
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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
C₂₁H₃₂BNO₅
Molecular Weight
389.29
Synonyms
INDEX NAME NOT YET ASSIGNED
SMILES
O=C(OC(C)(C)C)NC1CCCOC2=CC(B3OC(C)(C)C(C)(C)O3)=CC=C12
Tpsa
66.02
Logp
3.7242
H Acceptors
5
H Donors
1
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: C₂₁H₃₂BNO₅
Molecular Weight: 389.29
Synonyms: INDEX NAME NOT YET ASSIGNED
SMILES: O=C(OC(C)(C)C)NC1CCCOC2=CC(B3OC(C)(C)C(C)(C)O3)=CC=C12
Tpsa: 66.02
Logp: 3.7242
H Acceptors: 5
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:
C₂₁H₃₂BNO₅
Molecular Weight:
389.29
Synonyms:
INDEX NAME NOT YET ASSIGNED
SMILES:
O=C(OC(C)(C)C)NC1CCCOC2=CC(B3OC(C)(C)C(C)(C)O3)=CC=C12
Tpsa:
66.02
Logp:
3.7242
H Acceptors:
5
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: C₇H₁₂N₂O₂
Molecular Weight: 156.18
Synonyms: None
SMILES: [H][C@]12CCNC[C@@](NC(CO2)=O)1[H]
Tpsa: 50.36
Logp: -1.1367
H Acceptors: 3
H Donors: 2
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:
C₇H₁₂N₂O₂
Molecular Weight:
156.18
Synonyms:
None
SMILES:
[H][C@]12CCNC[C@@](NC(CO2)=O)1[H]
Tpsa:
50.36
Logp:
-1.1367
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
0
Purity: 95%
MDL No: MFCD04114109
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₈N₂O₂
Molecular Weight: 200.19
Synonyms: 2-PHENYL-3-NITROPYRIDINE
SMILES: O=[N+](C1=CC=CN=C1C2=CC=CC=C2)[O-]
Tpsa: 56.03
Logp: 2.6568
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 2
Purity:
95%
MDL No:
MFCD04114109
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₈N₂O₂
Molecular Weight:
200.19
Synonyms:
2-PHENYL-3-NITROPYRIDINE
SMILES:
O=[N+](C1=CC=CN=C1C2=CC=CC=C2)[O-]
Tpsa:
56.03
Logp:
2.6568
H Acceptors:
3
H Donors:
0
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: C₃₁H₃₄N₂O₈
Molecular Weight: 562.61
Synonyms: None
SMILES: O=C(O)[C@H](OC(C1=CC=C(C)C=C1)=O)[C@@H](OC(C2=CC=C(C)C=C2)=O)C(O)=O.N[C@@H]3[C@H](C4=CC=CC=C4)NCCC3
Tpsa: 165.25
Logp: 3.66204
H Acceptors: 8
H Donors: 4
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₁H₃₄N₂O₈
Molecular Weight:
562.61
Synonyms:
None
SMILES:
O=C(O)[C@H](OC(C1=CC=C(C)C=C1)=O)[C@@H](OC(C2=CC=C(C)C=C2)=O)C(O)=O.N[C@@H]3[C@H](C4=CC=CC=C4)NCCC3
Tpsa:
165.25
Logp:
3.66204
H Acceptors:
8
H Donors:
4
Rotatable Bonds:
8