CS-0495748
Benzyl (R)-(1-benzylazepan-3-yl)carbamate
Manufacturer: ChemScene
CAS Number: 1263795-87-4
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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
C₂₁H₂₆N₂O₂
Molecular Weight
338.44
Synonyms
Carbamic acid, N-[(3R)-hexahydro-1-(phenylmethyl)-1H-azepin-3-yl]-, phenylmethyl ester
SMILES
O=C(N[C@@H]1CCCCN(CC2=CC=CC=C2)C1)OCC1=CC=CC=C1
Tpsa
41.57
Logp
3.9675
H Acceptors
3
H Donors
1
Rotatable Bonds
5
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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: C₂₁H₂₆N₂O₂
Molecular Weight: 338.44
Synonyms: Carbamic acid, N-[(3R)-hexahydro-1-(phenylmethyl)-1H-azepin-3-yl]-, phenylmethyl ester
SMILES: O=C(N[C@@H]1CCCCN(CC2=CC=CC=C2)C1)OCC1=CC=CC=C1
Tpsa: 41.57
Logp: 3.9675
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₂₆N₂O₂
Molecular Weight:
338.44
Synonyms:
Carbamic acid, N-[(3R)-hexahydro-1-(phenylmethyl)-1H-azepin-3-yl]-, phenylmethyl ester
SMILES:
O=C(N[C@@H]1CCCCN(CC2=CC=CC=C2)C1)OCC1=CC=CC=C1
Tpsa:
41.57
Logp:
3.9675
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₉ClN₂
Molecular Weight: 144.60
Synonyms: None
SMILES: ClCCCC1=NNC=C1
Tpsa: 28.68
Logp: 1.5811
H Acceptors: 1
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:
C₆H₉ClN₂
Molecular Weight:
144.60
Synonyms:
None
SMILES:
ClCCCC1=NNC=C1
Tpsa:
28.68
Logp:
1.5811
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: MFCD28502685
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₁₀FN
Molecular Weight: 103.14
Synonyms: None
SMILES: FC[C@H]1CCNC1
Tpsa: 12.03
Logp: 0.5654
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD28502685
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₁₀FN
Molecular Weight:
103.14
Synonyms:
None
SMILES:
FC[C@H]1CCNC1
Tpsa:
12.03
Logp:
0.5654
H Acceptors:
1
H Donors:
1
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: C₆H₉ClN₂O₂
Molecular Weight: 176.60
Synonyms: None
SMILES: Cl.CC1=C(C(O)=O)C(C)=NN1
Tpsa: 65.98
Logp: 1.14654
H Acceptors: 2
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:
C₆H₉ClN₂O₂
Molecular Weight:
176.60
Synonyms:
None
SMILES:
Cl.CC1=C(C(O)=O)C(C)=NN1
Tpsa:
65.98
Logp:
1.14654
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
1