Structure

Di-boc-cystamine

CAS
67385-10-8
Catalog Number
ACM67385108
Category
Main Products
Molecular Weight
352.50
Molecular Formula
C14H28N2O4S2

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Specification

Synonyms
di-tert-Butyl (disulfanediylbis(ethane-2,1-diyl))dicarbamate; bis[2-(t-butoxycarbonylamino)]ethyl disulfide; tert-butyl 2,2-disulfanediylbis(ethane-2,1-diyl)dicarbamate; Di-Boc-cystamine; [2-(2-tert-butoxycarbonylamino-ethylsulfanyl)-thioethyl]carbamic acid tert-butyl ester; N,N-di-(tert-butyloxycarbonyl)-cystamine;
IUPAC Name
tert-butylN-[2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyldisulfanyl]ethyl]carbamate
Canonical SMILES
CC(C)(C)OC(=O)NCCSSCCNC(=O)OC(C)(C)C
InChI Key
HBTMWZADMHBLMY-UHFFFAOYSA-N
Boiling Point
477.2ºC at 760 mmHg
Melting Point
120-122ºC
Flash Point
242.4ºC
Density
1.128g/cm³
Appearance
White powder
Exact Mass
352.14900
Hazard Statements
Xn
What is the chemical formula of Di-Boc-cystamine?

The chemical formula of Di-Boc-cystamine is C14H28N2O4S2.

What is the molecular weight of Di-Boc-cystamine?

The molecular weight of Di-Boc-cystamine is 352.5 g/mol.

What is another name for Di-Boc-cystamine?

Another name for Di-Boc-cystamine is Bis-Boc-cystamine.

What is the IUPAC name of Di-Boc-cystamine?

The IUPAC name of Di-Boc-cystamine is tert-butyl N-[2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyldisulfanyl]ethyl]carbamate.

What is the InChIKey of Di-Boc-cystamine?

The InChIKey of Di-Boc-cystamine is HBTMWZADMHBLMY-UHFFFAOYSA-N.

How many hydrogen bond donor counts does Di-Boc-cystamine have?

Di-Boc-cystamine has 2 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does Di-Boc-cystamine have?

Di-Boc-cystamine has 6 hydrogen bond acceptor counts.

How many rotatable bond counts does Di-Boc-cystamine have?

Di-Boc-cystamine has 11 rotatable bond counts.

What is the topological polar surface area of Di-Boc-cystamine?

The topological polar surface area of Di-Boc-cystamine is 127Ų.

Is Di-Boc-cystamine a canonicalized compound?

Yes, Di-Boc-cystamine is a canonicalized compound.

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