CS-1097546
tert-Butyl (4-bromo-3-(cyanomethyl)phenyl)carbamate
Manufacturer: ChemScene
CAS Number: 2353659-59-1
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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
C₁₃H₁₅BrN₂O₂
Molecular Weight
311.17
Synonyms
None
SMILES
N#CCC1=CC(NC(OC(C)(C)C)=O)=CC=C1Br
Tpsa
62.12
Logp
3.86218
H Acceptors
3
H Donors
1
Rotatable Bonds
2
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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: C₁₃H₁₅BrN₂O₂
Molecular Weight: 311.17
Synonyms: None
SMILES: N#CCC1=CC(NC(OC(C)(C)C)=O)=CC=C1Br
Tpsa: 62.12
Logp: 3.86218
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:
C₁₃H₁₅BrN₂O₂
Molecular Weight:
311.17
Synonyms:
None
SMILES:
N#CCC1=CC(NC(OC(C)(C)C)=O)=CC=C1Br
Tpsa:
62.12
Logp:
3.86218
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: C₁₅H₂₁BrN₂O₄
Molecular Weight: 373.24
Synonyms: None
SMILES: O=C(NCCC1=CC(NC(OC(C)(C)C)=O)=CC=C1Br)OC
Tpsa: 76.66
Logp: 3.6946
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:
C₁₅H₂₁BrN₂O₄
Molecular Weight:
373.24
Synonyms:
None
SMILES:
O=C(NCCC1=CC(NC(OC(C)(C)C)=O)=CC=C1Br)OC
Tpsa:
76.66
Logp:
3.6946
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: C₂₃H₂₂BrF₃N₂O₂
Molecular Weight: 495.33
Synonyms: None
SMILES: FC(C1=C(C)N=C(N(CC2=CC=C(OC)C=C2)CC3=CC=C(OC)C=C3)C=C1Br)(F)F
Tpsa: 34.59
Logp: 6.39532
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₃H₂₂BrF₃N₂O₂
Molecular Weight:
495.33
Synonyms:
None
SMILES:
FC(C1=C(C)N=C(N(CC2=CC=C(OC)C=C2)CC3=CC=C(OC)C=C3)C=C1Br)(F)F
Tpsa:
34.59
Logp:
6.39532
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₉H₃₅BClNO₄
Molecular Weight: 507.86
Synonyms: None
SMILES: COC1=CC=C(CN(C2=CC(C)=CC(B3OC(C)(C)C(C)(C)O3)=C2Cl)CC4=CC=C(OC)C=C4)C=C1
Tpsa: 40.16
Logp: 6.17162
H Acceptors: 5
H Donors: 0
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:
C₂₉H₃₅BClNO₄
Molecular Weight:
507.86
Synonyms:
None
SMILES:
COC1=CC=C(CN(C2=CC(C)=CC(B3OC(C)(C)C(C)(C)O3)=C2Cl)CC4=CC=C(OC)C=C4)C=C1
Tpsa:
40.16
Logp:
6.17162
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
8