Flunitrazepam EP Impurity B

CAT: 1596-AR-F09386-05Size: 150Dry Ice: NoHazardous: No

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CAT#:1596-AR-F09386-05Size:150

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CAS Number

2558-30-7

API Name

Flunitrazepam

Chemical Information

Norflunitrazepam

CAS Number	2558-30-7
PubChem CID	520217
IUPAC Name	5-(2-fluorophenyl)-7-nitro-1,3-dihydro-1,4-benzodiazepin-2-one
Molecular Formula	C15H10FN3O3
Molecular Weight	299.26
XLogP	2.1
Topological Polar Surface Area	87.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Heavy Atom Count	22
Formal Charge	0
Complexity	491

SMILES

C1C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)C3=CC=CC=C3F

InChI

InChI=1S/C15H10FN3O3/c16-12-4-2-1-3-10(12)15-11-7-9(19(21)22)5-6-13(11)18-14(20)8-17-15/h1-7H,8H2,(H,18,20)

InChIKey

KNGIGRDYBQPXKQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2558-30-7

CID: 520217

Formula: C15H10FN3O3

MW: 299.26

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	299.26
XLogP3	2.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Exact Mass	299.07061935
Monoisotopic Mass	299.07061935
Topological Polar Surface Area	87.3 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	491
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
AR-F09385-01	Flunitrazepam EP Impurity A
AR-F09387-01	Flunitrazepam EP Impurity C
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AR-C02165-01	Ceftriaxone EP Impurity B (Cefotaxime EP Impurity E)
AR-P30581-01	Pemetrexed EP Impurity B and Pemetrexed EP Impurity C
AR-A01849-01	Ambroxol EP Impurity E (Bromhexine EP Impurity B)
AR-L01422-01	Letrozole EP Impurity B
AR-L01073-01	Lamivudine EP Impurity B