N-Boc-piperazine-d4

CAT: 0926-BVB62187Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0926-BVB62187Size:100 mg

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CAS Number

1126621-87-1

MDL Number

MFCD22565840

Smiles

CC (C) (C) OC (=O) N1CCNCC1

Molecular Formula

C9H14D4N2O2

Molecular Weight

190.28 g/mol

Controlled

Chemical Information

Piperazine-3,3,5,5-D4-N-t-BOC

CAS Number	1126621-87-1
PubChem CID	57607866
IUPAC Name	tert-butyl 3,3,5,5-tetradeuteriopiperazine-1-carboxylate
Molecular Formula	C9H18N2O2
Molecular Weight	190.28
XLogP	0.5
Topological Polar Surface Area	41.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	13
Formal Charge	0
Complexity	181

SMILES

[2H]C1(CN(CC(N1)([2H])[2H])C(=O)OC(C)(C)C)[2H]

InChI

InChI=1S/C9H18N2O2/c1-9(2,3)13-8(12)11-6-4-10-5-7-11/h10H,4-7H2,1-3H3/i4D2,5D2

InChIKey

CWXPZXBSDSIRCS-CQOLUAMGSA-N

Chemical Structure

2D Structure

CAS: 1126621-87-1

CID: 57607866

Formula: C9H18N2O2

MW: 190.28

Interactive 3D Structure

Loading 3D structure...

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