Catalog No.:AA019NPT

851175-84-3 | 3-(2,5-dimethyl-1-propyl-1H-pyrrol-3-yl)prop-2-enoic acid

Name: Name:3-(2,5-dimethyl-1-propyl-1H-pyrrol-3-yl)prop-2-enoic acid
Brand: AABLOCKS
SKU: AA019NPT
Rating: 90 (10 reviews)

This product is typically in stock,please click "Inquire" below or
contact us at [email protected] for pricing and availability information.

Technical Information
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Technical Information

Catalog Number:

AA019NPT

Chemical Name:

3-(2,5-dimethyl-1-propyl-1H-pyrrol-3-yl)prop-2-enoic acid

CAS Number:

851175-84-3

Molecular Formula:

C12H17NO2

Molecular Weight:

207.2689

MDL Number:

MFCD06373456

SMILES:

CCCn1c(C)cc(c1C)C=CC(=O)O

Properties

Computed Properties

Complexity:

250

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Rotatable Bond Count:

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2

Literature

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Historical Records

201537-87-3

851718-75-7

Tags:851175-84-3 Molecular Formula|851175-84-3 MDL|851175-84-3 SMILES|851175-84-3 3-(2,5-dimethyl-1-propyl-1H-pyrrol-3-yl)prop-2-enoic acid

Catalog No.: AA019NPT

851175-84-3 | 3-(2,5-dimethyl-1-propyl-1H-pyrrol-3-yl)prop-2-enoic acid

This product is typically in stock,please click "Inquire" below or contact us at [email protected]for pricing and availability information.

Inquire

Technical Information

Catalog Number: AA019NPT

Chemical Name: 3-(2,5-dimethyl-1-propyl-1H-pyrrol-3-yl)prop-2-enoic acid

CAS Number: 851175-84-3

Molecular Formula: C12H17NO2

Molecular Weight: 207.2689

MDL Number: MFCD06373456

SMILES: CCCn1c(C)cc(c1C)C=CC(=O)O

Properties

Complexity: 250

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 15

Hydrogen Bond Acceptor Count: 2

Hydrogen Bond Donor Count: 1

Isotope Atom Count: 0

Rotatable Bond Count: 4

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 1

XLogP3: 2.2

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