BOC-D-Aspartic Acid extrapure, 99%

CAT: 0565-38230-01Size: 10 gDry Ice: NoHazardous: No

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CAT#:0565-38230-01Size:10 g

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Description

Part B

CAS Number

62396-48-9

Storage Temperature

0 - 4°C

Chemical Information

Boc-D-Aspartic acid

CAS Number	62396-48-9
PubChem CID	7021110
IUPAC Name	(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanedioic acid
Molecular Formula	C9H15NO6
Molecular Weight	233.22
XLogP	0.1
Topological Polar Surface Area	113
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	6
Heavy Atom Count	16
Formal Charge	0
Complexity	293

SMILES

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

InChI

InChI=1S/C9H15NO6/c1-9(2,3)16-8(15)10-5(7(13)14)4-6(11)12/h5H,4H2,1-3H3,(H,10,15)(H,11,12)(H,13,14)/t5-/m1/s1

InChIKey

KAJBMCZQVSQJDE-RXMQYKEDSA-N

Chemical Structure

2D Structure

CAS: 62396-48-9

CID: 7021110

Formula: C9H15NO6

MW: 233.22

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	233.22
XLogP3	0.1
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	6
Exact Mass	233.08993720
Monoisotopic Mass	233.08993720
Topological Polar Surface Area	113 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	293
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

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