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113771-75-8

113771-75-8 | 2H-1-Benzopyran-3-methanamine, 3,4-dihydro-, hydrochloride (1:1)

CAS No: 113771-75-8 Catalog No: AG0009MI MDL No:MFCD07330841

Product Description

Catalog Number:
AG0009MI
Chemical Name:
2H-1-Benzopyran-3-methanamine, 3,4-dihydro-, hydrochloride (1:1)
CAS Number:
113771-75-8
Molecular Formula:
C10H14ClNO
Molecular Weight:
199.6773
MDL Number:
MFCD07330841
IUPAC Name:
3,4-dihydro-2H-chromen-3-ylmethanamine;hydrochloride
InChI:
InChI=1S/C10H13NO.ClH/c11-6-8-5-9-3-1-2-4-10(9)12-7-8;/h1-4,8H,5-7,11H2;1H
InChI Key:
GUNSFNGIYCIFOZ-UHFFFAOYSA-N
SMILES:
NCC1COc2c(C1)cccc2.Cl

Properties

Complexity:
149  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.076g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
199.678g/mol
Monoisotopic Mass:
199.076g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0

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