CS-0996724
(S)-tert-Butyl (8-bromo-6-fluoro-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-3-yl)carbamate
Manufacturer: ChemScene
CAS Number: 2837016-42-7
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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
C₁₅H₁₈BrFN₂O₃
Molecular Weight
373.22
Synonyms
None
SMILES
FC1=C2C(NC(=O)[C@@H](NC(OC(C)(C)C)=O)CC2)=CC(Br)=C1
Tpsa
67.43
Logp
3.3662
H Acceptors
3
H Donors
2
Rotatable Bonds
1
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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: C₁₅H₁₈BrFN₂O₃
Molecular Weight: 373.22
Synonyms: None
SMILES: FC1=C2C(NC(=O)[C@@H](NC(OC(C)(C)C)=O)CC2)=CC(Br)=C1
Tpsa: 67.43
Logp: 3.3662
H Acceptors: 3
H Donors: 2
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:
C₁₅H₁₈BrFN₂O₃
Molecular Weight:
373.22
Synonyms:
None
SMILES:
FC1=C2C(NC(=O)[C@@H](NC(OC(C)(C)C)=O)CC2)=CC(Br)=C1
Tpsa:
67.43
Logp:
3.3662
H Acceptors:
3
H Donors:
2
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: C₁₂H₁₁NO₅S
Molecular Weight: 281.28
Synonyms: None
SMILES: O=C(O)C=1C=C(OC)C2=NC=C(C=C2C1)S(=O)(=O)C
Tpsa: 93.56
Logp: 1.3451
H Acceptors: 5
H Donors: 1
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:
C₁₂H₁₁NO₅S
Molecular Weight:
281.28
Synonyms:
None
SMILES:
O=C(O)C=1C=C(OC)C2=NC=C(C=C2C1)S(=O)(=O)C
Tpsa:
93.56
Logp:
1.3451
H Acceptors:
5
H Donors:
1
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: C₅HBrF₃LiN₂O₂
Molecular Weight: 264.91
Synonyms: None
SMILES: O=C(C1=NC=C(N1C(F)(F)F)Br)O[Li]
Tpsa: 44.12
Logp: 1.3622
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:
C₅HBrF₃LiN₂O₂
Molecular Weight:
264.91
Synonyms:
None
SMILES:
O=C(C1=NC=C(N1C(F)(F)F)Br)O[Li]
Tpsa:
44.12
Logp:
1.3622
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: C₁₂H₁₁NO₄S
Molecular Weight: 265.29
Synonyms: None
SMILES: O=C(O)C1=CC2=CC(=CN=C2C(=C1)S(=O)(=O)C)C
Tpsa: 84.33
Logp: 1.64492
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:
C₁₂H₁₁NO₄S
Molecular Weight:
265.29
Synonyms:
None
SMILES:
O=C(O)C1=CC2=CC(=CN=C2C(=C1)S(=O)(=O)C)C
Tpsa:
84.33
Logp:
1.64492
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2