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Structure

8-(Phenylmethyl)-1,8-diazaspiro[4.5]decane

CAS
928034-30-4
Catalog Number
ACM928034304
Category
Other Products
Molecular Weight
230.348580 [g/mol]
Molecular Formula
C15H22N2

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Specification

Synonyms
8-BENZYL-1,8-DIAZASPIRO[4.5]DECANE, 928034-30-4, SureCN4504991, CTK5J6312, AG-C-29296, KB-64713, 1,8-Diazaspiro[4.5]decane,8-(phenylmethyl)-, A-1912, D-5161
IUPAC Name
8-benzyl-1,8-diazaspiro[4.5]decane
Canonical SMILES
C1CC2(CCN(CC2)CC3=CC=CC=C3)NC1
InChI Key
SFMBBIDDGLYJEU-UHFFFAOYSA-N
Boiling Point
340.8ºC at 760 mmHg
Flash Point
134.1ºC
Density
1.07g/cm³
Exact Mass
230.17800
H-Bond Acceptor
2
H-Bond Donor
1
What is the IUPAC name of the compound?

8-benzyl-1,8-diazaspiro[4.5]decane.

What is the molecular formula of the compound?

C15H22N2.

What is the molecular weight of the compound?

230.35 g/mol.

What is the InChI code for the compound?

InChI=1S/C15H22N2/c1-2-5-14(6-3-1)13-17-11-8-15(9-12-17)7-4-10-16-15/h1-3,5-6,16H,4,7-13H2.

What is the InChIKey for the compound?

SFMBBIDDGLYJEU-UHFFFAOYSA-N.

What is the canonical SMILES representation of the compound?

C1CC2(CCN(CC2)CC3=CC=CC=C3)NC1.

What is the CAS number of the compound?

928034-30-4.

What is the hydrogen bond donor count for the compound?

1.

What is the hydrogen bond acceptor count for the compound?

2.

Is the compound canonicalized?

Yes.

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