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Structure

1-(1-Propylcyclobutyl)methanamine

CAS
959239-92-0
Catalog Number
ACM959239920
Category
Other Products
Molecular Weight
127.227280 [g/mol]
Molecular Formula
C8H17N

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Specification

Synonyms
Ambcb4026729, CTK5H8392, MolPort-016-631-131, AKOS006282780, AG-H-94426, MCULE-8817838813, 1-(1-PROPYLCYCLOBUTYL)METHANAMINE, 959239-92-0
IUPAC Name
(1-propylcyclobutyl)methanamine
Canonical SMILES
CCCC1(CCC1)CN
InChI Key
OGRSNFHWCCXCGE-UHFFFAOYSA-N
Boiling Point
147.8ºC at 760 mmHg
Flash Point
37.5ºC
Density
0.858g/cm³
Exact Mass
127.13600
H-Bond Acceptor
1
H-Bond Donor
1
What is the molecular formula of the compound?

The molecular formula is C8H17N.

When was the compound first created?

The compound was first created on May 28, 2009.

What is the molecular weight of the compound?

The molecular weight is 127.23 g/mol.

What is the IUPAC name of the compound?

The IUPAC name is (1-propylcyclobutyl)methanamine.

What is the canonical SMILES representation of the compound?

The canonical SMILES representation is CCCC1(CCC1)CN.

What is the InChIKey of the compound?

The InChIKey is OGRSNFHWCCXCGE-UHFFFAOYSA-N.

How many hydrogen bond donor counts does the compound have?

The compound has 1 hydrogen bond donor count.

What is the exact mass of the compound?

The exact mass is 127.136099547 g/mol.

How many rotatable bond counts does the compound have?

The compound has 3 rotatable bond counts.

Is the compound canonicalized according to PubChem?

Yes, the compound is canonicalized according to PubChem.

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