Boc-α-propyl-DL-Pro-OH

CAT: 0024-sc-234123Size: 500 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-234123Size:500 mg

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CAS Number

351002-88-5

Chemical Information

Boc-a-Propyl-DL-proline

CAS Number	351002-88-5
PubChem CID	21656715
IUPAC Name	2-[(2-methylpropan-2-yl)oxycarbonyl]-1-propylpyrrolidine-2-carboxylic acid
Molecular Formula	C13H23NO4
Molecular Weight	257.33
XLogP	-0.1
Topological Polar Surface Area	66.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Heavy Atom Count	18
Formal Charge	0
Complexity	334

SMILES

CCCN1CCCC1(C(=O)O)C(=O)OC(C)(C)C

InChI

InChI=1S/C13H23NO4/c1-5-8-14-9-6-7-13(14,10(15)16)11(17)18-12(2,3)4/h5-9H2,1-4H3,(H,15,16)

InChIKey

DGOWTMFOLHCVDG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 351002-88-5

CID: 21656715

Formula: C13H23NO4

MW: 257.33

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	257.33
XLogP3	-0.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Exact Mass	257.16270821
Monoisotopic Mass	257.16270821
Topological Polar Surface Area	66.8 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	334
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-337592	Boc-DL-Pro-OH
sc-337592A	Boc-DL-Pro-OH
sc-234120	Boc-α- (diphenylmethyl) -DL-Pro-OH
sc-234121	Boc-α-allyl-DL-Pro-OH
sc-254988	Boc-α-Me-DL-Pro-OH
sc-234122	Boc-α-benzyl-DL-Pro-OH
sc-234116	Boc-α- (2-chlorobenzyl) -DL-Pro-OH
sc-234118	Boc-α- (4-fluorobenzyl) -DL-Pro-OH
sc-234114	Boc-α- (1-naphthylmethyl) -DL-Pro-OH
sc-227434	Boc-α- (4-bromobenzyl) -DL-Pro-OH