Boc-D-Glu-NH2

CAT: 0024-sc-293735Size: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-293735Size:1 g

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CAS Number

55297-72-8

Chemical Information

Boc-D-Glu-NH2

CAS Number	55297-72-8
PubChem CID	7015721
IUPAC Name	(4R)-5-amino-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoic acid
Molecular Formula	C10H18N2O5
Molecular Weight	246.26
XLogP	-1.1
Topological Polar Surface Area	119
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	7
Heavy Atom Count	17
Formal Charge	0
Complexity	308

SMILES

CC(C)(C)OC(=O)N[C@H](CCC(=O)O)C(=O)N

InChI

InChI=1S/C10H18N2O5/c1-10(2,3)17-9(16)12-6(8(11)15)4-5-7(13)14/h6H,4-5H2,1-3H3,(H2,11,15)(H,12,16)(H,13,14)/t6-/m1/s1

InChIKey

GMZBDBBBJXGPIH-ZCFIWIBFSA-N

Chemical Structure

2D Structure

CAS: 55297-72-8

CID: 7015721

Formula: C10H18N2O5

MW: 246.26

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	246.26
XLogP3	-1.1
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	7
Exact Mass	246.12157168
Monoisotopic Mass	246.12157168
Topological Polar Surface Area	119 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	308
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes